(E)-1-diazonio-3-[3-(phenylcarbonyl)phenyl]but-1-en-2-olate

Systemtic Name: (E)-1-diazonio-3-[3-(phenylcarbonyl)phenyl]but-1-en-2-olate Openeye Name: (E)-3-(3-benzoylphenyl)-1-diazonio-but-1-en-2-olate CAS Name: (E)-3-(3-benzoylphenyl)-1-diazonio-1-buten-2-olate IUPAC Name: (E)-3-(3-benzoylphenyl)-1-diazoniobut-1-en-2-olate Traditional Name: (E)-3-(3-benzoylphenyl)-1-diazonio-but-1-en-2-olate Formula: C17H14N2O2 MolecularWeight: 278.30526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=C[N+]#N)[O-]

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)/C(=C\[N+]#N)/[O-]

InChI

InChI=1S/C17H14N2O2/c1-12(16(20)11-19-18)14-8-5-9-15(10-14)17(21)13-6-3-2-4-7-13/h2-12H,1H3/b16-11+