3-[(4-methylphenyl)methyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-(p-tolylmethyl)-2H-oxadiazol-3-ium-5-one CAS Name: 3-[(4-methylphenyl)methyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[(4-methylphenyl)methyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-(4-methylbenzyl)-2H-oxadiazol-3-ium-5-one Formula: C10H11N2O2+ MolecularWeight: 191.20654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=CC(=O)ON2

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=CC(=O)ON2

InChI

InChI=1S/C10H10N2O2/c1-8-2-4-9(5-3-8)6-12-7-10(13)14-11-12/h2-5,7H,6H2,1H3/p+1