2-[(E)-2-[5-(3-ethoxycarbonylphenyl)furan-2-yl]ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate

Systemtic Name: 2-[(E)-2-[5-(3-ethoxycarbonylphenyl)furan-2-yl]ethenyl]-5-nitro-6-oxidanylidene-1H-pyrimidin-4-olate Openeye Name: 2-[(E)-2-[5-(3-ethoxycarbonylphenyl)-2-furyl]vinyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate CAS Name: 2-[(E)-2-[5-(3-ethoxycarbonylphenyl)-2-furanyl]ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate IUPAC Name: 2-[(E)-2-[5-(3-ethoxycarbonylphenyl)furan-2-yl]ethenyl]-5-nitro-6-oxo-1H-pyrimidin-4-olate Traditional Name: 2-[(E)-2-[5-(3-carbethoxyphenyl)-2-furyl]vinyl]-6-keto-5-nitro-1H-pyrimidin-4-olate Formula: C19H14N3O7- MolecularWeight: 396.33036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=CC=C(O2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H15N3O7/c1-2-28-19(25)12-5-3-4-11(10-12)14-8-6-13(29-14)7-9-15-20-17(23)16(22(26)27)18(24)21-15/h3-10H,2H2,1H3,(H2,20,21,23,24)/p-1/b9-7+