3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)oxadiazol-3-ium-5-olate CAS Name: 3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-oxadiazol-3-iumolate IUPAC Name: 3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)oxadiazol-3-ium-5-olate Traditional Name: 3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)oxadiazol-3-ium-5-olate Formula: C13H12N4O3 MolecularWeight: 272.25938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)[N+]3=NOC(=C3)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C13H12N4O3/c1-9-12(16-8-11(18)20-14-16)13(19)17(15(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3