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

Systemtic Name: O1-tert-butyl O2-methyl (2S)-4-[[1-(4-methylphenyl)sulfonylindol-3-yl]methyl]-5-oxidanylidene-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S)-5-oxo-4-[[1-(p-tolylsulfonyl)indol-3-yl]methyl]pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-4-[[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)-4-[[1-(4-methylphenyl)sulfonylindol-3-yl]methyl]-5-oxopyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-5-keto-4-[(1-tosylindol-3-yl)methyl]pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C27H30N2O7S MolecularWeight: 526.6013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC4CC(N(C4=O)C(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CC4C[C@H](N(C4=O)C(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C27H30N2O7S/c1-17-10-12-20(13-11-17)37(33,34)28-16-19(21-8-6-7-9-22(21)28)14-18-15-23(25(31)35-5)29(24(18)30)26(32)36-27(2,3)4/h6-13,16,18,23H,14-15H2,1-5H3/t18?,23-/m0/s1