3-methyl-4-phenyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-methyl-4-phenyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-methyl-4-phenyl-oxadiazol-3-ium-5-olate CAS Name: 3-methyl-4-phenyl-5-oxadiazol-3-iumolate IUPAC Name: 3-methyl-4-phenyloxadiazol-3-ium-5-olate Traditional Name: 3-methyl-4-phenyl-oxadiazol-3-ium-5-olate Formula: C9H8N2O2 MolecularWeight: 176.17202

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NOC(=C1C2=CC=CC=C2)[O-]

Isomeric SMILES

C[N+]1=NOC(=C1C2=CC=CC=C2)[O-]

InChI

InChI=1S/C9H8N2O2/c1-11-8(9(12)13-10-11)7-5-3-2-4-6-7/h2-6H,1H3