2-[(E)-1-cyano-2-(1-methylpyrrol-2-yl)ethenyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-(1-methylpyrrol-2-yl)ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-(1-methylpyrrol-2-yl)vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-(1-methyl-2-pyrrolyl)ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-(1-methylpyrrol-2-yl)ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-(1-methylpyrrol-2-yl)vinyl]quinazolin-4-olate Formula: C16H11N4O- MolecularWeight: 275.28474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=C(C#N)C2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CN1C=CC=C1/C=C(\C#N)/C2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C16H12N4O/c1-20-8-4-5-12(20)9-11(10-17)15-18-14-7-3-2-6-13(14)16(21)19-15/h2-9H,1H3,(H,18,19,21)/p-1/b11-9+