tert-butyl (2S,4R)-1-(4-methylphenyl)sulfonyl-4-oxidanyl-4-phenyl-pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S,4R)-1-(4-methylphenyl)sulfonyl-4-oxidanyl-4-phenyl-pyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S,4R)-4-hydroxy-4-phenyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-hydroxy-1-(4-methylphenyl)sulfonyl-4-phenyl-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4R)-4-hydroxy-1-(4-methylphenyl)sulfonyl-4-phenylpyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-4-phenyl-1-tosyl-pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC(C)(C)C)(C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@](C[C@H]2C(=O)OC(C)(C)C)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H27NO5S/c1-16-10-12-18(13-11-16)29(26,27)23-15-22(25,17-8-6-5-7-9-17)14-19(23)20(24)28-21(2,3)4/h5-13,19,25H,14-15H2,1-4H3/t19-,22-/m0/s1