(4-methylphenyl)methyl (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: p-tolylmethyl (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-2-pyrrolidinecarboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(3,4-dimethylphenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carboxylic acid (4-methylbenzyl) ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2CC(CN2S(=O)(=O)C3=CC(=C(C=C3)C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)[C@@H]2C[C@H](CN2S(=O)(=O)C3=CC(=C(C=C3)C)C)O

InChI

InChI=1S/C21H25NO5S/c1-14-4-7-17(8-5-14)13-27-21(24)20-11-18(23)12-22(20)28(25,26)19-9-6-15(2)16(3)10-19/h4-10,18,20,23H,11-13H2,1-3H3/t18-,20+/m1/s1