[(1S)-2-[2-(4-bromanylphenoxy)ethanoylamino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[2-(4-bromanylphenoxy)ethanoylamino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[2-(4-bromophenoxy)acetyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[2-(4-bromophenoxy)acetyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[[2-(4-bromophenoxy)acetyl]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C19H24BrN2O3+ MolecularWeight: 408.30946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN2O3/c1-22(2)18(14-5-4-6-17(11-14)24-3)12-21-19(23)13-25-16-9-7-15(20)8-10-16/h4-11,18H,12-13H2,1-3H3,(H,21,23)/p+1/t18-/m1/s1