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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=C1OC)C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC=C1OC)/C=C/C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O6/c1-3-24-13-9(5-4-6-11(13)23-2)7-8-10-12(18(21)22)14(19)17-15(20)16-10/h4-8H,3H2,1-2H3,(H2,16,17,19,20)/p-1/b8-7+