3-[(3-methoxy-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[(3-methoxy-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(3-methoxy-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(3-methoxy-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(3-methoxy-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(6-keto-3-methoxy-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-quinone Formula: C16H12N4O6 MolecularWeight: 356.28968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNN2C(=O)C3=CC=CC=C3NC2=O)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CNN2C(=O)C3=CC=CC=C3NC2=O)C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O6/c1-26-10-6-9(14(21)13(7-10)20(24)25)8-17-19-15(22)11-4-2-3-5-12(11)18-16(19)23/h2-8,17H,1H3,(H,18,23)