6-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: 6-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: 6-nitro-N-[(E)-(3-nitrophenyl)methyleneamino]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: 6-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: 6-nitro-N-[(E)-(3-nitrophenyl)methylideneamino]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 4-keto-6-nitro-N-[(E)-(3-nitrobenzylidene)amino]-1H-quinazoline-2-carboxamide Formula: C16H10N6O6 MolecularWeight: 382.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=NNC(=O)C2=NC(=O)C3=C(N2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=NC(=O)C3=C(N2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N6O6/c23-15-12-7-11(22(27)28)4-5-13(12)18-14(19-15)16(24)20-17-8-9-2-1-3-10(6-9)21(25)26/h1-8H,(H,20,24)(H,18,19,23)/b17-8+