(2E)-3-methyl-2-(phenylmethylidene)-3,4-dihydropyrazol-2-ium-5-olate

Systemtic Name: (2E)-3-methyl-2-(phenylmethylidene)-3,4-dihydropyrazol-2-ium-5-olate Openeye Name: (2E)-2-benzylidene-3-methyl-3,4-dihydropyrazol-2-ium-5-olate CAS Name: (2E)-3-methyl-2-(phenylmethylene)-3,4-dihydropyrazol-2-ium-5-olate IUPAC Name: (2E)-2-benzylidene-3-methyl-3,4-dihydropyrazol-2-ium-5-olate Traditional Name: (1E)-1-benzal-5-methyl-2-pyrazolin-1-ium-3-olate Formula: C11H12N2O MolecularWeight: 188.22578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=N[N+]1=CC2=CC=CC=C2)[O-]

Isomeric SMILES

CC\1CC(=N/[N+]1=C/C2=CC=CC=C2)[O-]

InChI

InChI=1S/C11H12N2O/c1-9-7-11(14)12-13(9)8-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3/b13-8+