2-[2-(carboxymethyloxy)-4,5-dimethoxy-phenyl]-2-[(4-cyanophenyl)amino]ethanoic acid

Systemtic Name: 2-[2-(carboxymethyloxy)-4,5-dimethoxy-phenyl]-2-[(4-cyanophenyl)amino]ethanoic acid Openeye Name: 2-[2-(carboxymethyloxy)-4,5-dimethoxy-phenyl]-2-(4-cyanoanilino)acetic acid CAS Name: 2-[2-(carboxymethyloxy)-4,5-dimethoxyphenyl]-2-(4-cyanoanilino)acetic acid IUPAC Name: 2-[2-(carboxymethyloxy)-4,5-dimethoxyphenyl]-2-(4-cyanoanilino)acetic acid Traditional Name: 2-[2-(carboxymethyloxy)-4,5-dimethoxy-phenyl]-2-(4-cyanoanilino)acetic acid Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(=O)O)OC

InChI

InChI=1S/C19H18N2O7/c1-26-15-7-13(14(8-16(15)27-2)28-10-17(22)23)18(19(24)25)21-12-5-3-11(9-20)4-6-12/h3-8,18,21H,10H2,1-2H3,(H,22,23)(H,24,25)