3-[(2R,3R)-3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxidanylidene-pyrrolidin-2-yl]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[(2R,3R)-3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxidanylidene-pyrrolidin-2-yl]propyl 4-methylbenzenesulfonate Openeye Name: 3-[(2R,3R)-5-oxo-3-(p-tolylsulfonyloxymethyl)pyrrolidin-2-yl]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[(2R,3R)-3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxo-2-pyrrolidinyl]propyl ester IUPAC Name: 3-[(2R,3R)-3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxopyrrolidin-2-yl]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-[(2R,3R)-5-keto-3-(tosyloxymethyl)pyrrolidin-2-yl]propyl ester Formula: C22H27NO7S2 MolecularWeight: 481.58228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2C(CC(=O)N2)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC[C@@H]2[C@@H](CC(=O)N2)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27NO7S2/c1-16-5-9-19(10-6-16)31(25,26)29-13-3-4-21-18(14-22(24)23-21)15-30-32(27,28)20-11-7-17(2)8-12-20/h5-12,18,21H,3-4,13-15H2,1-2H3,(H,23,24)/t18-,21+/m0/s1