N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-chloranyl-N,2-dimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-chloranyl-N,2-dimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-chloro-N,2-dimethyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-chloro-N,2-dimethyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-7-chloro-N,2-dimethyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-7-chloro-1-keto-N,2-dimethyl-4-phenyl-isoquinoline-3-carboxamide Formula: C27H19ClF6N2O2 MolecularWeight: 552.895379

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=C(C=C2)Cl)C3=CC=CC=C3)C(=O)N(C)CC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=C(C=C2)Cl)C3=CC=CC=C3)C(=O)N(C)CC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

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