ethyl 2,5-bis(4-chlorophenyl)-4-oxidanyl-1-(phenylsulfonyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-bis(4-chlorophenyl)-4-oxidanyl-1-(phenylsulfonyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-2,5-bis(4-chlorophenyl)-4-hydroxy-pyrrole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-2,5-bis(4-chlorophenyl)-4-hydroxy-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-2,5-bis(4-chlorophenyl)-4-hydroxypyrrole-3-carboxylate Traditional Name: 1-besyl-2,5-bis(4-chlorophenyl)-4-hydroxy-pyrrole-3-carboxylic acid ethyl ester Formula: C25H19Cl2NO5S MolecularWeight: 516.39306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1O)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1O)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H19Cl2NO5S/c1-2-33-25(30)21-22(16-8-12-18(26)13-9-16)28(34(31,32)20-6-4-3-5-7-20)23(24(21)29)17-10-14-19(27)15-11-17/h3-15,29H,2H2,1H3