[(2S,4R)-1-(4-methylphenyl)sulfonyl-4-methylsulfonyloxy-pyrrolidin-2-yl]methyl methanesulfonate

Systemtic Name: [(2S,4R)-1-(4-methylphenyl)sulfonyl-4-methylsulfonyloxy-pyrrolidin-2-yl]methyl methanesulfonate Openeye Name: [(2S,4R)-4-methylsulfonyloxy-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2S,4R)-1-(4-methylphenyl)sulfonyl-4-methylsulfonyloxy-2-pyrrolidinyl]methyl ester IUPAC Name: [(2S,4R)-1-(4-methylphenyl)sulfonyl-4-methylsulfonyloxypyrrolidin-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2S,4R)-4-methylsulfonyloxy-1-tosyl-pyrrolidin-2-yl]methyl ester Formula: C14H21NO8S3 MolecularWeight: 427.51344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2COS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C[C@H]2COS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C14H21NO8S3/c1-11-4-6-14(7-5-11)26(20,21)15-9-13(23-25(3,18)19)8-12(15)10-22-24(2,16)17/h4-7,12-13H,8-10H2,1-3H3/t12-,13+/m0/s1