ethyl 4-[4-oxidanyl-5-oxidanylidene-2-phenyl-3-(phenylsulfonyl)-2H-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[4-oxidanyl-5-oxidanylidene-2-phenyl-3-(phenylsulfonyl)-2H-pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]benzoate CAS Name: 4-[3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-phenyl-2H-pyrrol-1-yl]benzoate Traditional Name: 4-(4-besyl-3-hydroxy-2-keto-5-phenyl-3-pyrrolin-1-yl)benzoic acid ethyl ester Formula: C25H21NO6S MolecularWeight: 463.50234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C(=C(C2=O)O)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C(=C(C2=O)O)S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21NO6S/c1-2-32-25(29)18-13-15-19(16-14-18)26-21(17-9-5-3-6-10-17)23(22(27)24(26)28)33(30,31)20-11-7-4-8-12-20/h3-16,21,27H,2H2,1H3