[(2R)-2-(3-bromanyl-4-fluoranyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(3-bromanyl-4-fluoranyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Openeye Name: [(2R)-2-(3-bromo-4-fluoro-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium CAS Name: [(2R)-2-(3-bromo-4-fluorophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium IUPAC Name: [(2R)-2-(3-bromo-4-fluorophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Traditional Name: [(2R)-2-(3-bromo-4-fluoro-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium Formula: C17H19BrFN2+ MolecularWeight: 350.248563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(C[NH3+])C3=CC(=C(C=C3)F)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)[C@@H](C[NH3+])C3=CC(=C(C=C3)F)Br

InChI

InChI=1S/C17H18BrFN2/c18-15-9-13(5-6-16(15)19)17(10-20)21-8-7-12-3-1-2-4-14(12)11-21/h1-6,9,17H,7-8,10-11,20H2/p+1/t17-/m0/s1