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

Systemtic Name: 3-[(5-methyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(5-methyl-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(5-methyl-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(5-methyl-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(6-keto-5-methyl-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-1H-quinazoline-2,4-quinone Formula: C16H12N4O5 MolecularWeight: 340.29028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=CNN2C(=O)C3=CC=CC=C3NC2=O)C1=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=CNN2C(=O)C3=CC=CC=C3NC2=O)C1=O)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5/c1-9-6-11(20(24)25)7-10(14(9)21)8-17-19-15(22)12-4-2-3-5-13(12)18-16(19)23/h2-8,17H,1H3,(H,18,23)