5-bromanyl-7-nitro-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-8-amine

Systemtic Name: 5-bromanyl-7-nitro-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-8-amine Openeye Name: 5-bromo-7-nitro-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-8-amine CAS Name: 5-bromo-7-nitro-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-8-amine IUPAC Name: 5-bromo-7-nitro-2-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinolin-8-amine Traditional Name: [5-bromo-7-nitro-2-[4-(trifluoromethyl)benzyl]-3,4-dihydro-1H-isoquinolin-8-yl]amine Formula: C17H15BrF3N3O2 MolecularWeight: 430.21911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C(C(=CC(=C21)Br)[N+](=O)[O-])N)CC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CC2=C(C(=CC(=C21)Br)[N+](=O)[O-])N)CC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H15BrF3N3O2/c18-14-7-15(24(25)26)16(22)13-9-23(6-5-12(13)14)8-10-1-3-11(4-2-10)17(19,20)21/h1-4,7H,5-6,8-9,22H2