7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one

Systemtic Name: 7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Openeye Name: 7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one CAS Name: 7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one IUPAC Name: 7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Traditional Name: 7-(2-methoxyethyl)-3-[3-(trifluoromethyl)phenyl]-1H-cinnolin-5-one Formula: C18H15F3N2O2 MolecularWeight: 348.31911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCC1=CC(=O)C2=CC(=NNC2=C1)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

COCCC1=CC(=O)C2=CC(=NNC2=C1)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H15F3N2O2/c1-25-6-5-11-7-16-14(17(24)8-11)10-15(22-23-16)12-3-2-4-13(9-12)18(19,20)21/h2-4,7-10,23H,5-6H2,1H3