2-[2-(4-oxidanyl-5-oxidanylidene-1,2-diphenyl-2H-pyrrol-3-yl)ethyl]benzoic acid

Systemtic Name: 2-[2-(4-oxidanyl-5-oxidanylidene-1,2-diphenyl-2H-pyrrol-3-yl)ethyl]benzoic acid Openeye Name: 2-[2-(4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrol-3-yl)ethyl]benzoic acid CAS Name: 2-[2-(4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrol-3-yl)ethyl]benzoic acid IUPAC Name: 2-[2-(4-hydroxy-5-oxo-1,2-diphenyl-2H-pyrrol-3-yl)ethyl]benzoic acid Traditional Name: 2-[2-(4-hydroxy-5-keto-1,2-diphenyl-3-pyrrolin-3-yl)ethyl]benzoic acid Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=CC=CC=C3)O)CCC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=CC=CC=C3)O)CCC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C25H21NO4/c27-23-21(16-15-17-9-7-8-14-20(17)25(29)30)22(18-10-3-1-4-11-18)26(24(23)28)19-12-5-2-6-13-19/h1-14,22,27H,15-16H2,(H,29,30)