[(2S)-2-(azocan-1-yl)-2-(4-bromanylthiophen-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(azocan-1-yl)-2-(4-bromanylthiophen-2-yl)ethyl]azanium Openeye Name: [(2S)-2-(azocan-1-yl)-2-(4-bromo-2-thienyl)ethyl]ammonium CAS Name: [(2S)-2-(1-azocanyl)-2-(4-bromo-2-thiophenyl)ethyl]ammonium IUPAC Name: [(2S)-2-(azocan-1-yl)-2-(4-bromothiophen-2-yl)ethyl]azanium Traditional Name: [(2S)-2-(azocan-1-yl)-2-(4-bromo-2-thienyl)ethyl]ammonium Formula: C13H22BrN2S+ MolecularWeight: 318.29618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(C[NH3+])C2=CC(=CS2)Br

Isomeric SMILES

C1CCCN(CCC1)[C@@H](C[NH3+])C2=CC(=CS2)Br

InChI

InChI=1S/C13H21BrN2S/c14-11-8-13(17-10-11)12(9-15)16-6-4-2-1-3-5-7-16/h8,10,12H,1-7,9,15H2/p+1/t12-/m0/s1