2-[(1E,3Z)-3-methyl-4-phenyl-buta-1,3-dienyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-[(1E,3Z)-3-methyl-4-phenyl-buta-1,3-dienyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-[(1E,3Z)-3-methyl-4-phenyl-buta-1,3-dienyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(1E,3Z)-3-methyl-4-phenylbuta-1,3-dienyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-[(1E,3Z)-3-methyl-4-phenylbuta-1,3-dienyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate Traditional Name: 6-keto-2-[(1E,3Z)-3-methyl-4-phenyl-buta-1,3-dienyl]-5-nitro-1H-pyrimidin-4-olate Formula: C15H12N3O4- MolecularWeight: 298.27348

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-]

Isomeric SMILES

C/C(=C/C1=CC=CC=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C15H13N3O4/c1-10(9-11-5-3-2-4-6-11)7-8-12-16-14(19)13(18(21)22)15(20)17-12/h2-9H,1H3,(H2,16,17,19,20)/p-1/b8-7+,10-9-