2-[(E)-2-[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(E)-2-[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(E)-2-[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 2-[(E)-2-[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one IUPAC Name: 2-[(E)-2-[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Traditional Name: 2-[(E)-2-[2-(4-chlorobenzyl)oxy-3-methoxy-phenyl]vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Formula: C20H16ClN3O6 MolecularWeight: 429.81054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)C=CC3=NC(=C(C(=O)N3)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O

InChI

InChI=1S/C20H16ClN3O6/c1-29-15-4-2-3-13(18(15)30-11-12-5-8-14(21)9-6-12)7-10-16-22-19(25)17(24(27)28)20(26)23-16/h2-10H,11H2,1H3,(H2,22,23,25,26)/b10-7+