3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]benzamide

Systemtic Name: 3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]benzamide Openeye Name: 3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]benzamide CAS Name: 3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]benzamide IUPAC Name: 3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]benzamide Traditional Name: N-[(1-keto-2,6,7-trimethyl-4-phenyl-3-isoquinolyl)methyl]-3,5-bis(trifluoromethyl)benzamide Formula: C28H22F6N2O2 MolecularWeight: 532.476899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CNC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)CNC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4)C

InChI

InChI=1S/C28H22F6N2O2/c1-15-9-21-22(10-16(15)2)26(38)36(3)23(24(21)17-7-5-4-6-8-17)14-35-25(37)18-11-19(27(29,30)31)13-20(12-18)28(32,33)34/h4-13H,14H2,1-3H3,(H,35,37)