2-[(E)-2-[3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[(E)-2-[3-ethoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]ethenyl]-5-nitro-4-oxidanyl-1H-pyrimidin-6-one Openeye Name: 2-[(E)-2-[3-ethoxy-4-(2-morpholino-2-oxo-ethoxy)phenyl]vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one CAS Name: 2-[(E)-2-[3-ethoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one IUPAC Name: 2-[(E)-2-[3-ethoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Traditional Name: 2-[(E)-2-[3-ethoxy-4-(2-keto-2-morpholino-ethoxy)phenyl]vinyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one Formula: C20H22N4O8 MolecularWeight: 446.41068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC2=NC(=C(C(=O)N2)[N+](=O)[O-])O)OCC(=O)N3CCOCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O)OCC(=O)N3CCOCC3

InChI

InChI=1S/C20H22N4O8/c1-2-31-15-11-13(4-6-16-21-19(26)18(24(28)29)20(27)22-16)3-5-14(15)32-12-17(25)23-7-9-30-10-8-23/h3-6,11H,2,7-10,12H2,1H3,(H2,21,22,26,27)/b6-4+