O1-tert-butyl O2-methyl (2S,4R)-4-[[1-(4-methylphenyl)sulfonylindol-3-yl]-oxidanyl-methyl]-5-oxidanylidene-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2S,4R)-4-[[1-(4-methylphenyl)sulfonylindol-3-yl]-oxidanyl-methyl]-5-oxidanylidene-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S,4R)-4-[hydroxy-[1-(p-tolylsulfonyl)indol-3-yl]methyl]-5-oxo-pyrrolidine-1,2-dicarboxylate CAS Name: (2S,4R)-4-[hydroxy-[1-(4-methylphenyl)sulfonyl-3-indolyl]methyl]-5-oxopyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S,4R)-4-[hydroxy-[1-(4-methylphenyl)sulfonylindol-3-yl]methyl]-5-oxopyrrolidine-1,2-dicarboxylate Traditional Name: (2S,4R)-4-[hydroxy-(1-tosylindol-3-yl)methyl]-5-keto-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C27H30N2O8S MolecularWeight: 542.6007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C(C4CC(N(C4=O)C(=O)OC(C)(C)C)C(=O)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C([C@H]4C[C@H](N(C4=O)C(=O)OC(C)(C)C)C(=O)OC)O

InChI

InChI=1S/C27H30N2O8S/c1-16-10-12-17(13-11-16)38(34,35)28-15-20(18-8-6-7-9-21(18)28)23(30)19-14-22(25(32)36-5)29(24(19)31)26(33)37-27(2,3)4/h6-13,15,19,22-23,30H,14H2,1-5H3/t19-,22+,23?/m1/s1