2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-[(E)-2-(4-ethoxy-3-methoxyphenyl)ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate Traditional Name: 2-[(E)-2-(4-ethoxy-3-methoxy-phenyl)vinyl]-6-keto-5-nitro-1H-pyrimidin-4-olate Formula: C15H14N3O6- MolecularWeight: 332.28816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-])OC

InChI

InChI=1S/C15H15N3O6/c1-3-24-10-6-4-9(8-11(10)23-2)5-7-12-16-14(19)13(18(21)22)15(20)17-12/h4-8H,3H2,1-2H3,(H2,16,17,19,20)/p-1/b7-5+