4-[(E)-2-(3-methoxy-4-propoxy-phenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one

Systemtic Name: 4-[(E)-2-(3-methoxy-4-propoxy-phenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one Openeye Name: 4-[(E)-2-(3-methoxy-4-propoxy-phenyl)vinyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one CAS Name: 4-[(E)-2-(3-methoxy-4-propoxyphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one IUPAC Name: 4-[(E)-2-(3-methoxy-4-propoxyphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one Traditional Name: 4-[(E)-2-(3-methoxy-4-propoxy-phenyl)vinyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one Formula: C17H17F3N2O3 MolecularWeight: 354.32369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC2=NC(=O)NC(=C2)C(F)(F)F)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C2=NC(=O)NC(=C2)C(F)(F)F)OC

InChI

InChI=1S/C17H17F3N2O3/c1-3-8-25-13-7-5-11(9-14(13)24-2)4-6-12-10-15(17(18,19)20)22-16(23)21-12/h4-7,9-10H,3,8H2,1-2H3,(H,21,22,23)/b6-4+