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

Systemtic Name: methyl 2-(4-chlorophenyl)-4-methoxy-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-2H-pyrrole-3-carboxylate Openeye Name: methyl 2-(4-chlorophenyl)-4-methoxy-5-oxo-1-(p-tolylsulfonyl)-2H-pyrrole-3-carboxylate CAS Name: 2-(4-chlorophenyl)-4-methoxy-1-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-4-methoxy-1-(4-methylphenyl)sulfonyl-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 2-(4-chlorophenyl)-5-keto-4-methoxy-1-tosyl-3-pyrroline-3-carboxylic acid methyl ester Formula: C20H18ClNO6S MolecularWeight: 435.87802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18ClNO6S/c1-12-4-10-15(11-5-12)29(25,26)22-17(13-6-8-14(21)9-7-13)16(20(24)28-3)18(27-2)19(22)23/h4-11,17H,1-3H3