[(2S)-2-[(2R)-1-(4-methylphenyl)sulfonylaziridin-2-yl]propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-2-[(2R)-1-(4-methylphenyl)sulfonylaziridin-2-yl]propyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-2-[(2R)-1-(p-tolylsulfonyl)aziridin-2-yl]propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-2-[(2R)-1-(4-methylphenyl)sulfonyl-2-aziridinyl]propyl] ester IUPAC Name: [(2S)-2-[(2R)-1-(4-methylphenyl)sulfonylaziridin-2-yl]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-2-[(2R)-1-tosylethylenimin-2-yl]propyl] ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC2C(C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@H]2[C@H](C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H23NO5S2/c1-14-4-8-17(9-5-14)26(21,22)20-12-19(20)16(3)13-25-27(23,24)18-10-6-15(2)7-11-18/h4-11,16,19H,12-13H2,1-3H3/t16-,19+,20?/m1/s1