2,2-dimethyl-1,2-oxaziridin-2-ium-3-one; 1-(3-iodanylphenyl)ethanone

Systemtic Name: 2,2-dimethyl-1,2-oxaziridin-2-ium-3-one; 1-(3-iodanylphenyl)ethanone Openeye Name: 2,2-dimethyloxaziridin-2-ium-3-one; 1-(3-iodophenyl)ethanone CAS Name: 2,2-dimethyl-3-oxaziridin-2-iumone; 1-(3-iodophenyl)ethanone IUPAC Name: 2,2-dimethyloxaziridin-2-ium-3-one; 1-(3-iodophenyl)ethanone Traditional Name: 2,2-dimethyloxaziridin-2-ium-3-one; 1-(3-iodophenyl)ethanone Formula: C11H13INO3+ MolecularWeight: 334.13029

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)I.C[N+]1(C(=O)O1)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)I.C[N+]1(C(=O)O1)C

InChI

InChI=1S/C8H7IO.C3H6NO2/c1-6(10)7-3-2-4-8(9)5-7;1-4(2)3(5)6-4/h2-5H,1H3;1-2H3/q;+1