<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">311808</id>
  <title nil="true"/>
  <common-name>4-methoxy-n-[(e)-(2-prop-2-enoxyphenyl)methylideneamino]benzamide</common-name>
  <description nil="true"/>
  <cas nil="true"/>
  <pubchem-id>9612295</pubchem-id>
  <chemical-formula>C18H18N2O3</chemical-formula>
  <weight>310.3</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-29T08:07:12Z</created-at>
  <updated-at type="dateTime">2026-08-29T08:07:12Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>COC1=CC=C(C=C1)C(=O)NN=CC2=CC=CC=C2OCC=C</moldb-smiles>
  <moldb-formula>C18H18N2O3</moldb-formula>
  <moldb-inchi>InChI=1S/C18H18N2O3/c1-3-12-23-17-7-5-4-6-15(17)13-19-20-18(21)14-8-10-16(22-2)11-9-14/h3-11,13H,1,12H2,2H3,(H,20,21)/b19-13+</moldb-inchi>
  <moldb-inchikey>HSTODEZSGYYFIE-CPNJWEJPSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">310.1317424</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.4</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM307701</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>4-methoxy-n-[(e)-(2-prop-2-enoxyphenyl)methylideneamino]benzamide</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Benzoic acids and derivatives</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0262754</sync-id>
  <structure-inchikey>HSTODEZSGYYFIE-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000000000000000000400000000000000000000000000002200000000000000000000000000000400000000002000000000000000000000000000000000000000020000000000300000204000000000000040000010000010040000080000000000000081008000040000000000000000000000040000000800000000000000080008000000100000000000000000000000000000000000000000200084000002000000000080000000000000002000090000000000000000000000000040000400000004000000000000200000000000000000000000000001040002000000400000000100020000080000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������(������@(������@h�������@h�������@(������@h�������@h��������(�������(�������h��������(�������h�������@(������@h�������@h�������@h�������@h�������@(�������(�������`�������h��������h������������ ��h���h���h���h���h��� �	(��
 
� ��(�� �h���h���h���h���h��� ������������h��h�B���������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:18:53Z</structure-indexed-at>
</compound>
