[(2R,3R)-3-methyl-1-(4-methylphenyl)sulfonyl-aziridin-2-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(2R,3R)-3-methyl-1-(4-methylphenyl)sulfonyl-aziridin-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(2R,3R)-3-methyl-1-(p-tolylsulfonyl)aziridin-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2R,3R)-3-methyl-1-(4-methylphenyl)sulfonyl-2-aziridinyl]methyl ester IUPAC Name: [(2R,3R)-3-methyl-1-(4-methylphenyl)sulfonylaziridin-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2R,3R)-3-methyl-1-tosyl-ethylenimin-2-yl]methyl ester Formula: C18H21NO5S2 MolecularWeight: 395.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N1S(=O)(=O)C2=CC=C(C=C2)C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C[C@@H]1[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H21NO5S2/c1-13-4-8-16(9-5-13)25(20,21)19-15(3)18(19)12-24-26(22,23)17-10-6-14(2)7-11-17/h4-11,15,18H,12H2,1-3H3/t15-,18+,19?/m1/s1