2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzoic acid

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzoic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzoic acid CAS Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]benzoic acid Traditional Name: 2-(homoveratrylcarbamoyl)benzoic acid Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=CC=C2C(=O)O)OC

InChI

InChI=1S/C18H19NO5/c1-23-15-8-7-12(11-16(15)24-2)9-10-19-17(20)13-5-3-4-6-14(13)18(21)22/h3-8,11H,9-10H2,1-2H3,(H,19,20)(H,21,22)