2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-N-[4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[2-(2-ethoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]oxy-N-[4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolyl]oxy]-N-[4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[2-(2-ethoxyethyl)-1-oxo-5-isoquinolinyl]oxy]-N-[4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[2-(2-ethoxyethyl)-1-oxoisoquinolin-5-yl]oxy-N-[4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[2-(2-ethoxyethyl)-1-keto-5-isoquinolyl]oxy]-N-[4-(trifluoromethyl)phenyl]acetamide Formula: C22H21F3N2O4 MolecularWeight: 434.40835

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H21F3N2O4/c1-2-30-13-12-27-11-10-17-18(21(27)29)4-3-5-19(17)31-14-20(28)26-16-8-6-15(7-9-16)22(23,24)25/h3-11H,2,12-14H2,1H3,(H,26,28)