tert-butyl (2R,5S)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)-3-(phenylsulfonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2R,5S)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)-3-(phenylsulfonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2R,5S)-3-(benzenesulfonyl)-5-(benzyloxymethyl)-2-(tetrahydropyran-2-yloxymethyl)pyrrolidine-1-carboxylate CAS Name: (2R,5S)-3-(benzenesulfonyl)-2-(2-oxanyloxymethyl)-5-(phenylmethoxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2R,5S)-3-(benzenesulfonyl)-2-(oxan-2-yloxymethyl)-5-(phenylmethoxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2R,5S)-5-(benzoxymethyl)-3-besyl-2-(tetrahydropyran-2-yloxymethyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C29H39NO7S MolecularWeight: 545.68746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC(C1COC2CCCCO2)S(=O)(=O)C3=CC=CC=C3)COCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CC([C@H]1COC2CCCCO2)S(=O)(=O)C3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C29H39NO7S/c1-29(2,3)37-28(31)30-23(20-34-19-22-12-6-4-7-13-22)18-26(38(32,33)24-14-8-5-9-15-24)25(30)21-36-27-16-10-11-17-35-27/h4-9,12-15,23,25-27H,10-11,16-21H2,1-3H3/t23-,25+,26?,27?/m0/s1