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

Systemtic Name: ethyl (2S,5R)-2-(4-ethylphenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5R)-2-(4-ethylphenyl)-5-methyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5R)-2-(4-ethylphenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-2-(4-ethylphenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5R)-2-(4-ethylphenyl)-5-methyl-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=CC(N2S(=O)(=O)C3=CC=C(C=C3)C)C)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C(=C[C@H](N2S(=O)(=O)C3=CC=C(C=C3)C)C)C(=O)OCC

InChI

InChI=1S/C23H27NO4S/c1-5-18-9-11-19(12-10-18)22-21(23(25)28-6-2)15-17(4)24(22)29(26,27)20-13-7-16(3)8-14-20/h7-15,17,22H,5-6H2,1-4H3/t17-,22+/m1/s1