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

Systemtic Name: [3,3-dimethyl-1-(4-methylphenyl)sulfonyl-aziridin-2-yl]methyl 4-methylbenzenesulfonate Openeye Name: [3,3-dimethyl-1-(p-tolylsulfonyl)aziridin-2-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3,3-dimethyl-1-(4-methylphenyl)sulfonyl-2-aziridinyl]methyl ester IUPAC Name: [3,3-dimethyl-1-(4-methylphenyl)sulfonylaziridin-2-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3,3-dimethyl-1-tosyl-ethylenimin-2-yl)methyl ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2(C)C)COS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2(C)C)COS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H23NO5S2/c1-14-5-9-16(10-6-14)26(21,22)20-18(19(20,3)4)13-25-27(23,24)17-11-7-15(2)8-12-17/h5-12,18H,13H2,1-4H3