ethyl 4-[(2,4-dichlorophenyl)-oxidanyl-methyl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(2,4-dichlorophenyl)-oxidanyl-methyl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(2,4-dichlorophenyl)-hydroxy-methyl]-1-(p-tolylsulfonyl)pyrrole-2-carboxylate CAS Name: 4-[(2,4-dichlorophenyl)-hydroxymethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,4-dichlorophenyl)-hydroxymethyl]-1-(4-methylphenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 4-[(2,4-dichlorophenyl)-hydroxy-methyl]-1-tosyl-pyrrole-2-carboxylic acid ethyl ester Formula: C21H19Cl2NO5S MolecularWeight: 468.35026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=CC=C(C=C2)C)C(C3=C(C=C(C=C3)Cl)Cl)O

Isomeric SMILES

CCOC(=O)C1=CC(=CN1S(=O)(=O)C2=CC=C(C=C2)C)C(C3=C(C=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C21H19Cl2NO5S/c1-3-29-21(26)19-10-14(20(25)17-9-6-15(22)11-18(17)23)12-24(19)30(27,28)16-7-4-13(2)5-8-16/h4-12,20,25H,3H2,1-2H3