(3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-ol

Systemtic Name: (3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-ol Openeye Name: (3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-(p-tolylsulfonyl)pyrrolidin-3-ol CAS Name: (3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-(4-methylphenyl)sulfonyl-3-pyrrolidinol IUPAC Name: (3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-(4-methylphenyl)sulfonylpyrrolidin-3-ol Traditional Name: (3S,4S)-4-(3,4-dimethoxyphenyl)-4-ethyl-1-tosyl-pyrrolidin-3-ol Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CN(CC1O)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC[C@@]1(CN(C[C@H]1O)S(=O)(=O)C2=CC=C(C=C2)C)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27NO5S/c1-5-21(16-8-11-18(26-3)19(12-16)27-4)14-22(13-20(21)23)28(24,25)17-9-6-15(2)7-10-17/h6-12,20,23H,5,13-14H2,1-4H3/t20-,21-/m1/s1