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

Systemtic Name: 2-[(E)-1-cyano-2-(3-nitro-4-oxidanidyl-phenyl)ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-(3-nitro-4-oxido-phenyl)vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-(3-nitro-4-oxidophenyl)ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-(3-nitro-4-oxidophenyl)ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-(3-nitro-4-oxido-phenyl)vinyl]quinazolin-4-olate Formula: C17H8N4O4-2 MolecularWeight: 332.26982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])C#N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C(=C/C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/C#N)[O-]

InChI

InChI=1S/C17H10N4O4/c18-9-11(7-10-5-6-15(22)14(8-10)21(24)25)16-19-13-4-2-1-3-12(13)17(23)20-16/h1-8,22H,(H,19,20,23)/p-2/b11-7+