4-ethanoyl-3-(4-methylphenyl)-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-ethanoyl-3-(4-methylphenyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-acetyl-3-(p-tolyl)oxadiazol-3-ium-5-olate CAS Name: 4-acetyl-3-(4-methylphenyl)-5-oxadiazol-3-iumolate IUPAC Name: 4-acetyl-3-(4-methylphenyl)oxadiazol-3-ium-5-olate Traditional Name: 4-acetyl-3-(p-tolyl)oxadiazol-3-ium-5-olate Formula: C11H10N2O3 MolecularWeight: 218.2087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C)[O-]

InChI

InChI=1S/C11H10N2O3/c1-7-3-5-9(6-4-7)13-10(8(2)14)11(15)16-12-13/h3-6H,1-2H3