2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]quinazolin-4-olate

Systemtic Name: 2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]quinazolin-4-olate Openeye Name: 2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]quinazolin-4-olate CAS Name: 2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]-4-quinazolinolate IUPAC Name: 2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]quinazolin-4-olate Traditional Name: 2-[(1E,3E)-1-cyano-4-(2-methoxyphenyl)buta-1,3-dienyl]quinazolin-4-olate Formula: C20H14N3O2- MolecularWeight: 328.34406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC=C(C#N)C2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

COC1=CC=CC=C1/C=C/C=C(\C#N)/C2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C20H15N3O2/c1-25-18-12-5-2-7-14(18)8-6-9-15(13-21)19-22-17-11-4-3-10-16(17)20(24)23-19/h2-12H,1H3,(H,22,23,24)/p-1/b8-6+,15-9+