[(2R)-2-(5-bromanyl-2-fluoranyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium

Systemtic Name: [(2R)-2-(5-bromanyl-2-fluoranyl-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Openeye Name: [(2R)-2-(5-bromo-2-fluoro-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium CAS Name: [(2R)-2-(5-bromo-2-fluorophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium IUPAC Name: [(2R)-2-(5-bromo-2-fluorophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Traditional Name: [(2R)-2-(5-bromo-2-fluoro-phenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium Formula: C17H19BrFN2+ MolecularWeight: 350.248563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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