2-[(E)-C-cyano-N-[(4-fluorophenyl)amino]carbonimidoyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-C-cyano-N-[(4-fluorophenyl)amino]carbonimidoyl]quinazolin-4-olate Openeye Name: 2-[(E)-C-cyano-N-(4-fluoroanilino)carbonimidoyl]quinazolin-4-olate CAS Name: 2-[(E)-cyano-[(4-fluorophenyl)hydrazinylidene]methyl]-4-quinazolinolate IUPAC Name: 2-[(E)-C-cyano-N-(4-fluoroanilino)carbonimidoyl]quinazolin-4-olate Traditional Name: 2-[(E)-C-cyano-N-(4-fluoroanilino)carbonimidoyl]quinazolin-4-olate Formula: C16H9FN5O- MolecularWeight: 306.273963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=NNC3=CC=C(C=C3)F)C#N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C(=N/NC3=CC=C(C=C3)F)/C#N)[O-]

InChI

InChI=1S/C16H10FN5O/c17-10-5-7-11(8-6-10)21-22-14(9-18)15-19-13-4-2-1-3-12(13)16(23)20-15/h1-8,21H,(H,19,20,23)/p-1/b22-14+