6-chloranyl-7-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one

Systemtic Name: 6-chloranyl-7-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Openeye Name: 6-chloro-7-morpholino-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one CAS Name: 6-chloro-7-(4-morpholinyl)-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one IUPAC Name: 6-chloro-7-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-1-one Traditional Name: 6-chloro-7-morpholino-3-[2-(trifluoromethyl)phenyl]isocarbostyril Formula: C20H16ClF3N2O2 MolecularWeight: 408.80145

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C3C=C(NC(=O)C3=C2)C4=CC=CC=C4C(F)(F)F)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C3C=C(NC(=O)C3=C2)C4=CC=CC=C4C(F)(F)F)Cl

InChI

InChI=1S/C20H16ClF3N2O2/c21-16-9-12-10-17(13-3-1-2-4-15(13)20(22,23)24)25-19(27)14(12)11-18(16)26-5-7-28-8-6-26/h1-4,9-11H,5-8H2,(H,25,27)