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

Systemtic Name: 2-[[3-[2-(3,4-dimethoxyphenyl)ethanoylamino]phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoyl]amino]benzoic acid CAS Name: 2-[[[3-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]benzoyl]amino]benzoic acid Traditional Name: 2-[[3-(homoveratroylamino)benzoyl]amino]benzoic acid Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)OC

InChI

InChI=1S/C24H22N2O6/c1-31-20-11-10-15(12-21(20)32-2)13-22(27)25-17-7-5-6-16(14-17)23(28)26-19-9-4-3-8-18(19)24(29)30/h3-12,14H,13H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)