[(1R)-2-[2-(3-bromanylphenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[2-(3-bromanylphenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[2-(3-bromophenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[2-(3-bromophenoxy)-1-oxoethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[2-(3-bromophenoxy)acetyl]amino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[2-(3-bromophenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C16H20BrN2O2S+ MolecularWeight: 384.3112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)COC1=CC(=CC=C1)Br)C2=CC=CS2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)COC1=CC(=CC=C1)Br)C2=CC=CS2

InChI

InChI=1S/C16H19BrN2O2S/c1-19(2)14(15-7-4-8-22-15)10-18-16(20)11-21-13-6-3-5-12(17)9-13/h3-9,14H,10-11H2,1-2H3,(H,18,20)/p+1/t14-/m1/s1