methyl 4-[1-(4-methylphenyl)-3-(4-methylphenyl)sulfonyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[1-(4-methylphenyl)-3-(4-methylphenyl)sulfonyl-4-oxidanyl-5-oxidanylidene-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[4-hydroxy-5-oxo-1-(p-tolyl)-3-(p-tolylsulfonyl)-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-1-(4-methylphenyl)-3-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-1-(4-methylphenyl)-3-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[4-hydroxy-5-keto-1-(p-tolyl)-3-tosyl-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C26H23NO6S MolecularWeight: 477.52892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(=C(C2=O)O)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(=C(C2=O)O)S(=O)(=O)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H23NO6S/c1-16-4-12-20(13-5-16)27-22(18-8-10-19(11-9-18)26(30)33-3)24(23(28)25(27)29)34(31,32)21-14-6-17(2)7-15-21/h4-15,22,28H,1-3H3