7-nitro-3-(2-oxidanylidenepropyl)quinazolin-4-one

Systemtic Name: 7-nitro-3-(2-oxidanylidenepropyl)quinazolin-4-one Openeye Name: 3-acetonyl-7-nitro-quinazolin-4-one CAS Name: 7-nitro-3-(2-oxopropyl)-4-quinazolinone IUPAC Name: 7-nitro-3-(2-oxopropyl)quinazolin-4-one Traditional Name: 3-acetonyl-7-nitro-quinazolin-4-one Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CN1C=NC2=C(C1=O)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4/c1-7(15)5-13-6-12-10-4-8(14(17)18)2-3-9(10)11(13)16/h2-4,6H,5H2,1H3