N-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-N-methyl-3,5-bis(trifluoromethyl)benzamide Formula: C27H19ClF6N2O2 MolecularWeight: 552.895379

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CN(C)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CN(C)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H19ClF6N2O2/c1-35(24(37)16-10-17(26(29,30)31)12-18(11-16)27(32,33)34)14-22-23(15-6-4-3-5-7-15)21-13-19(28)8-9-20(21)25(38)36(22)2/h3-13H,14H2,1-2H3