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

Systemtic Name: N-methyl-3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]benzamide Openeye Name: N-methyl-3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]benzamide CAS Name: N-methyl-3,5-bis(trifluoromethyl)-N-[(2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]benzamide IUPAC Name: N-methyl-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]-N-methyl-3,5-bis(trifluoromethyl)benzamide Formula: C29H24F6N2O2 MolecularWeight: 546.503479

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H24F6N2O2/c1-16-10-22-23(11-17(16)2)27(39)37(4)24(25(22)18-8-6-5-7-9-18)15-36(3)26(38)19-12-20(28(30,31)32)14-21(13-19)29(33,34)35/h5-14H,15H2,1-4H3