1-(3,3-dimethyl-4-sulfinyl-butan-2-yl)oxyheptan-3-yl methanesulfonate; 2-octadecyl-1,2-oxaziridin-3-one

Systemtic Name: 1-(3,3-dimethyl-4-sulfinyl-butan-2-yl)oxyheptan-3-yl methanesulfonate; 2-octadecyl-1,2-oxaziridin-3-one Openeye Name: 2-octadecyloxaziridin-3-one; 1-[2-(1,2,2-trimethyl-3-sulfinyl-propoxy)ethyl]pentyl methanesulfonate CAS Name: methanesulfonic acid 1-(3,3-dimethyl-4-sulfinylbutan-2-yl)oxyheptan-3-yl ester; 2-octadecyl-3-oxaziridinone IUPAC Name: 1-(3,3-dimethyl-4-sulfinylbutan-2-yl)oxyheptan-3-yl methanesulfonate; 2-octadecyloxaziridin-3-one Traditional Name: methanesulfonic acid 1-[2-(1,2,2-trimethyl-3-sulfinyl-propoxy)ethyl]pentyl ester; 2-stearyloxaziridin-3-one Formula: C33H65NO7S2 MolecularWeight: 652.0017

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(=O)O1.CCCCC(CCOC(C)C(C)(C)C=S=O)OS(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(=O)O1.CCCCC(CCOC(C)C(C)(C)C=S=O)OS(=O)(=O)C

InChI

InChI=1S/C19H37NO2.C14H28O5S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(21)22-20;1-6-7-8-13(19-21(5,16)17)9-10-18-12(2)14(3,4)11-20-15/h2-18H2,1H3;11-13H,6-10H2,1-5H3