2-(4-nitrophenyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-(4-nitrophenyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-(4-nitrophenyl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-(4-nitrophenyl)-1H-quinazoline-7-carboxylate Formula: C15H8N3O5- MolecularWeight: 310.24112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O5/c19-14-11-6-3-9(15(20)21)7-12(11)16-13(17-14)8-1-4-10(5-2-8)18(22)23/h1-7H,(H,20,21)(H,16,17,19)/p-1