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

Systemtic Name: ethyl (2S,5R)-2-(4-dimethylaminophenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5R)-2-(4-dimethylaminophenyl)-5-methyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5R)-2-(4-dimethylaminophenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5R)-2-(4-dimethylaminophenyl)-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5R)-2-(4-dimethylaminophenyl)-5-methyl-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H28N2O4S/c1-6-29-23(26)21-15-17(3)25(30(27,28)20-13-7-16(2)8-14-20)22(21)18-9-11-19(12-10-18)24(4)5/h7-15,17,22H,6H2,1-5H3/t17-,22+/m1/s1