2-[2-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one

Systemtic Name: 2-[2-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Openeye Name: 2-[2-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one CAS Name: 2-[2-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)ethylidene]-1H-quinazolin-4-one IUPAC Name: 2-[2-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Traditional Name: 2-[2-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)ethylidene]-1H-quinazolin-4-one Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NC(=CC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NC(=CC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2

InChI

InChI=1S/C16H11N3O4/c20-14-7-5-10(9-13(14)19(22)23)6-8-15-17-12-4-2-1-3-11(12)16(21)18-15/h1-9,17H,(H,18,21)