4-[2-(2-carboxyethyl)-5-phenyl-pyrrol-1-yl]benzoic acid

Systemtic Name: 4-[2-(2-carboxyethyl)-5-phenyl-pyrrol-1-yl]benzoic acid Openeye Name: 4-[2-(2-carboxyethyl)-5-phenyl-pyrrol-1-yl]benzoic acid CAS Name: 4-[2-(2-carboxyethyl)-5-phenyl-1-pyrrolyl]benzoic acid IUPAC Name: 4-[2-(2-carboxyethyl)-5-phenylpyrrol-1-yl]benzoic acid Traditional Name: 4-[2-(2-carboxyethyl)-5-phenyl-pyrrol-1-yl]benzoic acid Formula: C20H17NO4 MolecularWeight: 335.35328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)C(=O)O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(N2C3=CC=C(C=C3)C(=O)O)CCC(=O)O

InChI

InChI=1S/C20H17NO4/c22-19(23)13-11-17-10-12-18(14-4-2-1-3-5-14)21(17)16-8-6-15(7-9-16)20(24)25/h1-10,12H,11,13H2,(H,22,23)(H,24,25)