1-cyclopropylcarbonyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-cyclopropylcarbonyl-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(cyclopropanecarbonyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[cyclopropyl(oxo)methyl]-N-[(2R)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-(cyclopropanecarbonyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(cyclopropanecarbonyl)-N-[(2R)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]isonipecotamide Formula: C22H34N3O2S+ MolecularWeight: 404.58926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2CCN(CC2)C(=O)C3CC3)C4=CC=CS4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2CCN(CC2)C(=O)C3CC3)C4=CC=CS4

InChI

InChI=1S/C22H33N3O2S/c1-16-6-10-24(11-7-16)19(20-3-2-14-28-20)15-23-21(26)17-8-12-25(13-9-17)22(27)18-4-5-18/h2-3,14,16-19H,4-13,15H2,1H3,(H,23,26)/p+1/t19-/m1/s1