[(1S)-1-(4-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-methoxyphenyl)-2-[3-(2-thienyl)propanoylamino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-methoxyphenyl)-2-[(1-oxo-3-thiophen-2-ylpropyl)amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-methoxyphenyl)-2-(3-thiophen-2-ylpropanoylamino)ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-methoxyphenyl)-2-[3-(2-thienyl)propanoylamino]ethyl]-dimethyl-ammonium Formula: C18H25N2O2S+ MolecularWeight: 333.4683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCC1=CC=CS1)C2=CC=C(C=C2)OC

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CCC1=CC=CS1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H24N2O2S/c1-20(2)17(14-6-8-15(22-3)9-7-14)13-19-18(21)11-10-16-5-4-12-23-16/h4-9,12,17H,10-11,13H2,1-3H3,(H,19,21)/p+1/t17-/m1/s1