methyl 4-methoxy-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-2H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-methoxy-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-2H-pyrrole-3-carboxylate Openeye Name: methyl 4-methoxy-5-oxo-2-(p-tolyl)-1-(p-tolylsulfonyl)-2H-pyrrole-3-carboxylate CAS Name: 4-methoxy-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 5-keto-4-methoxy-2-(p-tolyl)-1-tosyl-3-pyrroline-3-carboxylic acid methyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2S(=O)(=O)C3=CC=C(C=C3)C)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(C(=O)N2S(=O)(=O)C3=CC=C(C=C3)C)OC)C(=O)OC

InChI

InChI=1S/C21H21NO6S/c1-13-5-9-15(10-6-13)18-17(21(24)28-4)19(27-3)20(23)22(18)29(25,26)16-11-7-14(2)8-12-16/h5-12,18H,1-4H3