methyl 4-(4-chlorophenyl)-3-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(4-chlorophenyl)-3-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)-3-[(E)-2-(p-tolyl)vinyl]sulfonyl-pyrrole-3-carboxylate CAS Name: 4-(4-chlorophenyl)-3-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-3-[(E)-2-(4-methylphenyl)ethenyl]sulfonylpyrrole-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-3-[(E)-2-(p-tolyl)vinyl]sulfonyl-pyrrole-3-carboxylic acid methyl ester Formula: C21H18ClNO4S MolecularWeight: 415.88992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CS(=O)(=O)C2(C=NC=C2C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/S(=O)(=O)C2(C=NC=C2C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C21H18ClNO4S/c1-15-3-5-16(6-4-15)11-12-28(25,26)21(20(24)27-2)14-23-13-19(21)17-7-9-18(22)10-8-17/h3-14H,1-2H3/b12-11+