2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one

Systemtic Name: 2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one Openeye Name: 2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one CAS Name: 2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one IUPAC Name: 2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one Traditional Name: 2-(2-methylcyclohexyl)-4,1,2-benzoxadiazin-2-ium-3-one Formula: C14H17N2O2+ MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[N+]2=NC3=CC=CC=C3OC2=O

Isomeric SMILES

CC1CCCCC1[N+]2=NC3=CC=CC=C3OC2=O

InChI

InChI=1S/C14H17N2O2/c1-10-6-2-4-8-12(10)16-14(17)18-13-9-5-3-7-11(13)15-16/h3,5,7,9-10,12H,2,4,6,8H2,1H3/q+1