(4E)-6-methyl-5-nitro-4-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-one

Systemtic Name: (4E)-6-methyl-5-nitro-4-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-one Openeye Name: (4E)-6-methyl-5-nitro-4-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-one CAS Name: (4E)-6-methyl-5-nitro-4-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrimidin-2-one IUPAC Name: (4E)-6-methyl-5-nitro-4-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrimidin-2-one Traditional Name: (4E)-4-(6-ketocyclohexa-2,4-dien-1-ylidene)-6-methyl-5-nitro-1H-pyrimidin-2-one Formula: C11H9N3O4 MolecularWeight: 247.20686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=CC2=O)NC(=O)N1)[N+](=O)[O-]

Isomeric SMILES

CC1=C(/C(=C\2/C=CC=CC2=O)/NC(=O)N1)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4/c1-6-10(14(17)18)9(13-11(16)12-6)7-4-2-3-5-8(7)15/h2-5H,1H3,(H2,12,13,16)/b9-7+