2-methyl-2-(5-methyl-3-oxidanylidene-hexyl)-1,2-oxaziridin-2-ium-3-one

Systemtic Name: 2-methyl-2-(5-methyl-3-oxidanylidene-hexyl)-1,2-oxaziridin-2-ium-3-one Openeye Name: 2-methyl-2-(5-methyl-3-oxo-hexyl)oxaziridin-2-ium-3-one CAS Name: 2-methyl-2-(5-methyl-3-oxohexyl)-3-oxaziridin-2-iumone IUPAC Name: 2-methyl-2-(5-methyl-3-oxohexyl)oxaziridin-2-ium-3-one Traditional Name: 2-(3-keto-5-methyl-hexyl)-2-methyl-oxaziridin-2-ium-3-one Formula: C9H16NO3+ MolecularWeight: 186.22824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CC[N+]1(C(=O)O1)C

Isomeric SMILES

CC(C)CC(=O)CC[N+]1(C(=O)O1)C

InChI

InChI=1S/C9H16NO3/c1-7(2)6-8(11)4-5-10(3)9(12)13-10/h7H,4-6H2,1-3H3/q+1