N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(1-oxidanylidene-2-prop-2-enyl-isoquinolin-5-yl)oxy-ethanamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(1-oxidanylidene-2-prop-2-enyl-isoquinolin-5-yl)oxy-ethanamide Openeye Name: 2-[(2-allyl-1-oxo-5-isoquinolyl)oxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(1-oxo-2-prop-2-enyl-5-isoquinolinyl)oxy]acetamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(1-oxo-2-prop-2-enylisoquinolin-5-yl)oxyacetamide Traditional Name: 2-[(2-allyl-1-keto-5-isoquinolyl)oxy]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide Formula: C21H16ClF3N2O3 MolecularWeight: 436.81155

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C=CCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C21H16ClF3N2O3/c1-2-9-27-10-8-14-15(20(27)29)4-3-5-18(14)30-12-19(28)26-17-11-13(21(23,24)25)6-7-16(17)22/h2-8,10-11H,1,9,12H2,(H,26,28)