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

Systemtic Name: 6-[(E)-2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-4-oxidanylidene-1H-pyrimidin-2-olate Openeye Name: 6-[(E)-2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]vinyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate CAS Name: 6-[(E)-2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate IUPAC Name: 6-[(E)-2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-4-oxo-1H-pyrimidin-2-olate Traditional Name: 6-[(E)-2-[3-ethoxy-4-(2-fluorobenzyl)oxy-phenyl]vinyl]-4-keto-5-nitro-1H-pyrimidin-2-olate Formula: C21H17FN3O6- MolecularWeight: 426.374583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])OCC3=CC=CC=C3F

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=C(C(=O)N=C(N2)[O-])[N+](=O)[O-])OCC3=CC=CC=C3F

InChI

InChI=1S/C21H18FN3O6/c1-2-30-18-11-13(7-9-16-19(25(28)29)20(26)24-21(27)23-16)8-10-17(18)31-12-14-5-3-4-6-15(14)22/h3-11H,2,12H2,1H3,(H2,23,24,26,27)/p-1/b9-7+