3-[2-(3,4-dimethoxyphenyl)ethanoylamino]benzoate

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethanoylamino]benzoate Openeye Name: 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoate CAS Name: 3-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]benzoate IUPAC Name: 3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoate Traditional Name: 3-(homoveratroylamino)benzoate Formula: C17H16NO5- MolecularWeight: 314.31264

Click to see the large picture

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)/p-1