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

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethanoylamino]benzoic acid Openeye Name: 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid CAS Name: 3-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoic acid Traditional Name: 3-(homoveratroylamino)benzoic acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C17H17NO5/c1-22-14-7-6-11(8-15(14)23-2)9-16(19)18-13-5-3-4-12(10-13)17(20)21/h3-8,10H,9H2,1-2H3,(H,18,19)(H,20,21)