ethyl (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: ethyl (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5S)-5-tert-butyl-2-(3-chlorophenyl)-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C24H28ClNO4S MolecularWeight: 462.00142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(N(C1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C[C@H](N([C@H]1C2=CC(=CC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C)C(C)(C)C

InChI

InChI=1S/C24H28ClNO4S/c1-6-30-23(27)20-15-21(24(3,4)5)26(22(20)17-8-7-9-18(25)14-17)31(28,29)19-12-10-16(2)11-13-19/h7-15,21-22H,6H2,1-5H3/t21-,22-/m0/s1