(phenylmethyl) (2S,3S,4S)-1-(4-methylphenyl)sulfonyl-3-oxidanyl-4-(phenylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S,3S,4S)-1-(4-methylphenyl)sulfonyl-3-oxidanyl-4-(phenylmethyl)pyrrolidine-2-carboxylate Openeye Name: benzyl (2S,3S,4S)-4-benzyl-3-hydroxy-1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: (2S,3S,4S)-3-hydroxy-1-(4-methylphenyl)sulfonyl-4-(phenylmethyl)-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3S,4S)-4-benzyl-3-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S,3S,4S)-4-benzyl-3-hydroxy-1-tosyl-pyrrolidine-2-carboxylic acid benzyl ester Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2C(=O)OCC3=CC=CC=C3)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]([C@@H]([C@H]2C(=O)OCC3=CC=CC=C3)O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27NO5S/c1-19-12-14-23(15-13-19)33(30,31)27-17-22(16-20-8-4-2-5-9-20)25(28)24(27)26(29)32-18-21-10-6-3-7-11-21/h2-15,22,24-25,28H,16-18H2,1H3/t22-,24-,25-/m0/s1