N-[[1-azanyl-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]ethanamide

Systemtic Name: N-[[1-azanyl-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]ethanamide Openeye Name: N-[[1-amino-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]acetamide CAS Name: N-[[1-amino-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]acetamide IUPAC Name: N-[[1-amino-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]acetamide Traditional Name: N-[[1-amino-3-phenyl-3-(trifluoromethyl)-4H-isoquinolin-6-yl]methyl]acetamide Formula: C19H18F3N3O MolecularWeight: 361.36093

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC2=C(C=C1)C(=NC(C2)(C3=CC=CC=C3)C(F)(F)F)N

Isomeric SMILES

CC(=O)NCC1=CC2=C(C=C1)C(=NC(C2)(C3=CC=CC=C3)C(F)(F)F)N

InChI

InChI=1S/C19H18F3N3O/c1-12(26)24-11-13-7-8-16-14(9-13)10-18(19(20,21)22,25-17(16)23)15-5-3-2-4-6-15/h2-9H,10-11H2,1H3,(H2,23,25)(H,24,26)