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

Systemtic Name: 2-[2-(carboxymethyloxy)-5-ethyl-phenyl]-2-[(4-cyanophenyl)amino]ethanoic acid Openeye Name: 2-[2-(carboxymethyloxy)-5-ethyl-phenyl]-2-(4-cyanoanilino)acetic acid CAS Name: 2-[2-(carboxymethyloxy)-5-ethylphenyl]-2-(4-cyanoanilino)acetic acid IUPAC Name: 2-[2-(carboxymethyloxy)-5-ethylphenyl]-2-(4-cyanoanilino)acetic acid Traditional Name: 2-[2-(carboxymethyloxy)-5-ethyl-phenyl]-2-(4-cyanoanilino)acetic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)O)C(C(=O)O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)O)C(C(=O)O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H18N2O5/c1-2-12-5-8-16(26-11-17(22)23)15(9-12)18(19(24)25)21-14-6-3-13(10-20)4-7-14/h3-9,18,21H,2,11H2,1H3,(H,22,23)(H,24,25)