diethyl 2-[[1-(4-methylphenyl)sulfonylaziridin-2-yl]methyl]-2-prop-2-enyl-propanedioate

Systemtic Name: diethyl 2-[[1-(4-methylphenyl)sulfonylaziridin-2-yl]methyl]-2-prop-2-enyl-propanedioate Openeye Name: diethyl 2-allyl-2-[[1-(p-tolylsulfonyl)aziridin-2-yl]methyl]propanedioate CAS Name: 2-[[1-(4-methylphenyl)sulfonyl-2-aziridinyl]methyl]-2-prop-2-enylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[[1-(4-methylphenyl)sulfonylaziridin-2-yl]methyl]-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-[(1-tosylethylenimin-2-yl)methyl]malonic acid diethyl ester Formula: C20H27NO6S MolecularWeight: 409.49648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=C)(CC1CN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC=C)(CC1CN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC

InChI

InChI=1S/C20H27NO6S/c1-5-12-20(18(22)26-6-2,19(23)27-7-3)13-16-14-21(16)28(24,25)17-10-8-15(4)9-11-17/h5,8-11,16H,1,6-7,12-14H2,2-4H3