2-[(E)-1-cyano-2-(4-methoxy-3-nitro-phenyl)ethenyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-(4-methoxy-3-nitro-phenyl)ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-(4-methoxy-3-nitro-phenyl)vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-(4-methoxy-3-nitrophenyl)ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-(4-methoxy-3-nitrophenyl)ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-(4-methoxy-3-nitro-phenyl)vinyl]quinazolin-4-olate Formula: C18H11N4O4- MolecularWeight: 347.30434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12N4O4/c1-26-16-7-6-11(9-15(16)22(24)25)8-12(10-19)17-20-14-5-3-2-4-13(14)18(23)21-17/h2-9H,1H3,(H,20,21,23)/p-1/b12-8+