4-[[(2S)-1-(4-carboxylatophenyl)-5-oxidanylidene-2-phenyl-2H-pyrrol-4-yl]amino]benzoate

Systemtic Name: 4-[[(2S)-1-(4-carboxylatophenyl)-5-oxidanylidene-2-phenyl-2H-pyrrol-4-yl]amino]benzoate Openeye Name: 4-[[(2S)-1-(4-carboxylatophenyl)-5-oxo-2-phenyl-2H-pyrrol-4-yl]amino]benzoate CAS Name: 4-[[(2S)-1-(4-carboxylatophenyl)-5-oxo-2-phenyl-2H-pyrrol-4-yl]amino]benzoate IUPAC Name: 4-[[(2S)-1-(4-carboxylatophenyl)-5-oxo-2-phenyl-2H-pyrrol-4-yl]amino]benzoate Traditional Name: 4-[[(5S)-1-(4-carboxylatophenyl)-2-keto-5-phenyl-3-pyrrolin-3-yl]amino]benzoate Formula: C24H16N2O5-2 MolecularWeight: 412.39424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=C(C(=O)N2C3=CC=C(C=C3)C(=O)[O-])NC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2C=C(C(=O)N2C3=CC=C(C=C3)C(=O)[O-])NC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C24H18N2O5/c27-22-20(25-18-10-6-16(7-11-18)23(28)29)14-21(15-4-2-1-3-5-15)26(22)19-12-8-17(9-13-19)24(30)31/h1-14,21,25H,(H,28,29)(H,30,31)/p-2/t21-/m0/s1