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

Systemtic Name: 3-(2-methylphenyl)-4-nitro-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 4-nitro-3-(o-tolyl)-2H-oxadiazol-3-ium-5-one CAS Name: 3-(2-methylphenyl)-4-nitro-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-(2-methylphenyl)-4-nitro-2H-oxadiazol-3-ium-5-one Traditional Name: 4-nitro-3-(o-tolyl)-2H-oxadiazol-3-ium-5-one Formula: C9H8N3O4+ MolecularWeight: 222.17752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7N3O4/c1-6-4-2-3-5-7(6)11-8(12(14)15)9(13)16-10-11/h2-5H,1H3/p+1