tert-butyl (2S,3R,4R)-4-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3R,4R)-4-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,3R,4R)-3-benzyloxy-2-(benzyloxymethyl)-4-(p-tolylsulfonyl)pyrrolidine-1-carboxylate CAS Name: (2S,3R,4R)-4-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R,4R)-4-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,3R,4R)-3-benzoxy-2-(benzoxymethyl)-4-tosyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C31H37NO6S MolecularWeight: 551.69358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CN(C(C2OCC3=CC=CC=C3)COCC4=CC=CC=C4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@@H]2CN([C@H]([C@H]2OCC3=CC=CC=C3)COCC4=CC=CC=C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C31H37NO6S/c1-23-15-17-26(18-16-23)39(34,35)28-19-32(30(33)38-31(2,3)4)27(22-36-20-24-11-7-5-8-12-24)29(28)37-21-25-13-9-6-10-14-25/h5-18,27-29H,19-22H2,1-4H3/t27-,28+,29+/m0/s1