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

Systemtic Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]-2-(2,3,4-trimethoxyphenyl)ethanamide Openeye Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-2-(2,3,4-trimethoxyphenyl)acetamide CAS Name: N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-2-(2,3,4-trimethoxyphenyl)acetamide IUPAC Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]-2-(2,3,4-trimethoxyphenyl)acetamide Traditional Name: N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]-2-(2,3,4-trimethoxyphenyl)acetamide Formula: C23H33N2O4S+ MolecularWeight: 433.58412

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)CC2=C(C(=C(C=C2)OC)OC)OC)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNC(=O)CC2=C(C(=C(C=C2)OC)OC)OC)C3=CC=CS3

InChI

InChI=1S/C23H32N2O4S/c1-16-9-11-25(12-10-16)18(20-6-5-13-30-20)15-24-21(26)14-17-7-8-19(27-2)23(29-4)22(17)28-3/h5-8,13,16,18H,9-12,14-15H2,1-4H3,(H,24,26)/p+1/t18-/m0/s1