2-nitro-4-[(2R)-4-oxidanylidene-2,3-dihydro-1H-quinazolin-2-yl]phenolate

Systemtic Name: 2-nitro-4-[(2R)-4-oxidanylidene-2,3-dihydro-1H-quinazolin-2-yl]phenolate Openeye Name: 2-nitro-4-[(2R)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenolate CAS Name: 2-nitro-4-[(2R)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenolate IUPAC Name: 2-nitro-4-[(2R)-4-oxo-2,3-dihydro-1H-quinazolin-2-yl]phenolate Traditional Name: 4-[(2R)-4-keto-2,3-dihydro-1H-quinazolin-2-yl]-2-nitro-phenolate Formula: C14H10N3O4- MolecularWeight: 284.2469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O4/c18-12-6-5-8(7-11(12)17(20)21)13-15-10-4-2-1-3-9(10)14(19)16-13/h1-7,13,15,18H,(H,16,19)/p-1/t13-/m1/s1