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

Systemtic Name: 6-[(E)-2-[2-(cyanomethoxy)phenyl]ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[(E)-2-[2-(cyanomethoxy)phenyl]vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[(E)-2-[2-(cyanomethoxy)phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[(E)-2-[2-(cyanomethoxy)phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[(E)-2-[2-(cyanomethoxy)phenyl]vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C14H9N4O5- MolecularWeight: 313.24506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N4O5/c15-7-8-23-11-4-2-1-3-9(11)5-6-10-12(18(21)22)13(19)17-14(20)16-10/h1-6H,8H2,(H2,16,17,19,20)/p-1/b6-5+