3-(4-methylphenyl)-2H-1,2,3,4-oxatriazol-3-ium-5-one

Systemtic Name: 3-(4-methylphenyl)-2H-1,2,3,4-oxatriazol-3-ium-5-one Openeye Name: 3-(p-tolyl)-2H-oxatriazol-3-ium-5-one CAS Name: 3-(4-methylphenyl)-2H-oxatriazol-3-ium-5-one IUPAC Name: 3-(4-methylphenyl)-2H-oxatriazol-3-ium-5-one Traditional Name: 3-(p-tolyl)-2H-oxatriazol-3-ium-5-one Formula: C8H8N3O2+ MolecularWeight: 178.16802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7N3O2/c1-6-2-4-7(5-3-6)11-9-8(12)13-10-11/h2-5H,1H3/p+1