5-nitro-6-oxidanylidene-2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]-1H-pyrimidin-4-olate

Systemtic Name: 5-nitro-6-oxidanylidene-2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]-1H-pyrimidin-4-olate Openeye Name: 2-[(E)-2-(4-isopropylphenyl)vinyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 5-nitro-6-oxo-2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]-1H-pyrimidin-4-olate IUPAC Name: 5-nitro-6-oxo-2-[(E)-2-(4-propan-2-ylphenyl)ethenyl]-1H-pyrimidin-4-olate Traditional Name: 6-keto-5-nitro-2-[(E)-2-p-cumenylvinyl]-1H-pyrimidin-4-olate Formula: C15H14N3O4- MolecularWeight: 300.28936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O4/c1-9(2)11-6-3-10(4-7-11)5-8-12-16-14(19)13(18(21)22)15(20)17-12/h3-9H,1-2H3,(H2,16,17,19,20)/p-1/b8-5+