2-[(E)-1-cyano-2-(4-methoxyphenyl)ethenyl]-6-fluoranyl-quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-(4-methoxyphenyl)ethenyl]-6-fluoranyl-quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-(4-methoxyphenyl)vinyl]-6-fluoro-quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-(4-methoxyphenyl)ethenyl]-6-fluoro-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-(4-methoxyphenyl)ethenyl]-6-fluoroquinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-(4-methoxyphenyl)vinyl]-6-fluoro-quinazolin-4-olate Formula: C18H11FN3O2- MolecularWeight: 320.297243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(C=C(C=C3)F)C(=N2)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=C(C=C(C=C3)F)C(=N2)[O-]

InChI

InChI=1S/C18H12FN3O2/c1-24-14-5-2-11(3-6-14)8-12(10-20)17-21-16-7-4-13(19)9-15(16)18(23)22-17/h2-9H,1H3,(H,21,22,23)/p-1/b12-8+