2-[(E)-1-cyano-2-(3-methoxyphenyl)ethenyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-(3-methoxyphenyl)ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-(3-methoxyphenyl)vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-(3-methoxyphenyl)ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-(3-methoxyphenyl)ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-(3-methoxyphenyl)vinyl]quinazolin-4-olate Formula: C18H12N3O2- MolecularWeight: 302.30678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O2/c1-23-14-6-4-5-12(10-14)9-13(11-19)17-20-16-8-3-2-7-15(16)18(22)21-17/h2-10H,1H3,(H,20,21,22)/p-1/b13-9+