2-cyclopropylethanenitrile; methanesulfonate; 2-octadecyl-1,2-oxaziridin-3-one

Systemtic Name: 2-cyclopropylethanenitrile; methanesulfonate; 2-octadecyl-1,2-oxaziridin-3-one Openeye Name: 2-cyclopropylacetonitrile; methanesulfonate; 2-octadecyloxaziridin-3-one CAS Name: 2-cyclopropylacetonitrile; methanesulfonate; 2-octadecyl-3-oxaziridinone IUPAC Name: 2-cyclopropylacetonitrile; methanesulfonate; 2-octadecyloxaziridin-3-one Traditional Name: 2-cyclopropylacetonitrile; 2-stearyloxaziridin-3-one; mesylate Formula: C25H47N2O5S- MolecularWeight: 487.71608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C(=O)O1.CS(=O)(=O)[O-].C1CC1CC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C(=O)O1.CS(=O)(=O)[O-].C1CC1CC#N

InChI

InChI=1S/C19H37NO2.C5H7N.CH4O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19(21)22-20;6-4-3-5-1-2-5;1-5(2,3)4/h2-18H2,1H3;5H,1-3H2;1H3,(H,2,3,4)/p-1