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

Systemtic Name: methyl 4-(4-chlorophenyl)-3-[(E)-2-phenylethenyl]sulfonyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(4-chlorophenyl)-3-[(E)-styryl]sulfonyl-pyrrole-3-carboxylate CAS Name: 4-(4-chlorophenyl)-3-[(E)-2-phenylethenyl]sulfonyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-3-[(E)-2-phenylethenyl]sulfonylpyrrole-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-3-[(E)-styryl]sulfonyl-pyrrole-3-carboxylic acid methyl ester Formula: C20H16ClNO4S MolecularWeight: 401.86334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C=NC=C1C2=CC=C(C=C2)Cl)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1(C=NC=C1C2=CC=C(C=C2)Cl)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H16ClNO4S/c1-26-19(23)20(27(24,25)12-11-15-5-3-2-4-6-15)14-22-13-18(20)16-7-9-17(21)10-8-16/h2-14H,1H3/b12-11+