[(2S)-2-(5-bromanylthiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(5-bromanylthiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Openeye Name: [(2S)-2-(5-bromo-2-thienyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium CAS Name: [(2S)-2-(5-bromo-2-thiophenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium IUPAC Name: [(2S)-2-(5-bromothiophen-2-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]azanium Traditional Name: [(2S)-2-(5-bromo-2-thienyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]ammonium Formula: C15H18BrN2S+ MolecularWeight: 338.28582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(C[NH3+])C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)[C@@H](C[NH3+])C3=CC=C(S3)Br

InChI

InChI=1S/C15H17BrN2S/c16-15-6-5-14(19-15)13(9-17)18-8-7-11-3-1-2-4-12(11)10-18/h1-6,13H,7-10,17H2/p+1/t13-/m0/s1