4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)isoquinolin-7-yl]benzenecarbonitrile

Systemtic Name: 4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)isoquinolin-7-yl]benzenecarbonitrile Openeye Name: 4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)-7-isoquinolyl]benzonitrile CAS Name: 4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)-7-isoquinolinyl]benzonitrile IUPAC Name: 4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)isoquinolin-7-yl]benzonitrile Traditional Name: 4-[4-methyl-3-(methylamino)-1-(trifluoromethyl)-7-isoquinolyl]benzonitrile Formula: C19H14F3N3 MolecularWeight: 341.32977

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C2=C1C=CC(=C2)C3=CC=C(C=C3)C#N)C(F)(F)F)NC

Isomeric SMILES

CC1=C(N=C(C2=C1C=CC(=C2)C3=CC=C(C=C3)C#N)C(F)(F)F)NC

InChI

InChI=1S/C19H14F3N3/c1-11-15-8-7-14(13-5-3-12(10-23)4-6-13)9-16(15)17(19(20,21)22)25-18(11)24-2/h3-9H,1-2H3,(H,24,25)