N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(2,6-dimethylphenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(2,6-dimethylphenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(2,6-dimethylphenyl)-2-methyl-1-oxo-isoquinoline-3-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(2,6-dimethylphenyl)-2-methyl-1-oxo-3-isoquinolinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-4-(2,6-dimethylphenyl)-2-methyl-1-oxoisoquinoline-3-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-4-(2,6-dimethylphenyl)-1-keto-2-methyl-isoquinoline-3-carboxamide Formula: C28H22F6N2O2 MolecularWeight: 532.476899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=C(N(C(=O)C3=CC=CC=C32)C)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=C(N(C(=O)C3=CC=CC=C32)C)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

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