8-bromanyl-2-[[3-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-5,6-diamine

Systemtic Name: 8-bromanyl-2-[[3-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-5,6-diamine Openeye Name: 8-bromo-2-[[3-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-5,6-diamine CAS Name: 8-bromo-2-[[3-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-5,6-diamine IUPAC Name: 8-bromo-2-[[3-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-5,6-diamine Traditional Name: [5-amino-8-bromo-2-[3-(trifluoromethyl)benzyl]-3,4-dihydro-1H-isoquinolin-6-yl]amine Formula: C17H17BrF3N3 MolecularWeight: 400.23619

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C(C=C(C(=C21)N)N)Br)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CN(CC2=C(C=C(C(=C21)N)N)Br)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H17BrF3N3/c18-14-7-15(22)16(23)12-4-5-24(9-13(12)14)8-10-2-1-3-11(6-10)17(19,20)21/h1-3,6-7H,4-5,8-9,22-23H2