N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide

Systemtic Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide CAS Name: N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-3-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-3-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-3-(3,4,5-trimethoxyphenyl)propionamide Formula: C24H35N2O4S+ MolecularWeight: 447.6107

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNC(=O)CCC2=CC(=C(C(=C2)OC)OC)OC)C3=CC=CS3

InChI

InChI=1S/C24H34N2O4S/c1-17-9-11-26(12-10-17)19(22-6-5-13-31-22)16-25-23(27)8-7-18-14-20(28-2)24(30-4)21(15-18)29-3/h5-6,13-15,17,19H,7-12,16H2,1-4H3,(H,25,27)/p+1/t19-/m0/s1