4-nitro-2-(4-oxidanylidene-1H-quinazolin-2-yl)phenolate

Systemtic Name: 4-nitro-2-(4-oxidanylidene-1H-quinazolin-2-yl)phenolate Openeye Name: 4-nitro-2-(4-oxo-1H-quinazolin-2-yl)phenolate CAS Name: 4-nitro-2-(4-oxo-1H-quinazolin-2-yl)phenolate IUPAC Name: 4-nitro-2-(4-oxo-1H-quinazolin-2-yl)phenolate Traditional Name: 2-(4-keto-1H-quinazolin-2-yl)-4-nitro-phenolate Formula: C14H8N3O4- MolecularWeight: 282.23102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9N3O4/c18-12-6-5-8(17(20)21)7-10(12)13-15-11-4-2-1-3-9(11)14(19)16-13/h1-7,18H,(H,15,16,19)/p-1