(2S,3R,4R)-3-(2-hydroxyethyl)-4-(4-methylphenyl)sulfonyloxy-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,3R,4R)-3-(2-hydroxyethyl)-4-(4-methylphenyl)sulfonyloxy-1-phenylmethoxycarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,3R,4R)-1-benzyloxycarbonyl-3-(2-hydroxyethyl)-4-(p-tolylsulfonyloxy)pyrrolidine-2-carboxylic acid CAS Name: (2S,3R,4R)-3-(2-hydroxyethyl)-4-(4-methylphenyl)sulfonyloxy-1-phenylmethoxycarbonyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,3R,4R)-3-(2-hydroxyethyl)-4-(4-methylphenyl)sulfonyloxy-1-phenylmethoxycarbonylpyrrolidine-2-carboxylic acid Traditional Name: (2S,3R,4R)-1-carbobenzoxy-3-(2-hydroxyethyl)-4-tosyloxy-proline Formula: C22H25NO8S MolecularWeight: 463.5008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CN(C(C2CCO)C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H]2CN([C@@H]([C@H]2CCO)C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO8S/c1-15-7-9-17(10-8-15)32(28,29)31-19-13-23(20(21(25)26)18(19)11-12-24)22(27)30-14-16-5-3-2-4-6-16/h2-10,18-20,24H,11-14H2,1H3,(H,25,26)/t18-,19-,20-/m0/s1