ethyl (2S,5R)-5-methyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: ethyl (2S,5R)-5-methyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5R)-5-methyl-2-(p-tolyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5R)-5-methyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-5-methyl-2-(4-methylphenyl)-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5R)-5-methyl-2-(p-tolyl)-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4S/c1-5-27-22(24)20-14-17(4)23(21(20)18-10-6-15(2)7-11-18)28(25,26)19-12-8-16(3)9-13-19/h6-14,17,21H,5H2,1-4H3/t17-,21+/m1/s1