1-[1-(3-methylsulfanylpropyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-(3-methylsulfanylpropyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(3-methylsulfanylpropyl)piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[3-(methylthio)propyl]-4-piperidin-1-iumyl]-N-[[(2R)-2-oxolanyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(3-methylsulfanylpropyl)piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-[3-(methylthio)propyl]piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C20H39N3O2S+2 MolecularWeight: 385.60756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC[NH+]1CCC(CC1)[NH+]2CCC(CC2)C(=O)NCC3CCCO3

Isomeric SMILES

CSCCC[NH+]1CCC(CC1)[NH+]2CCC(CC2)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C20H37N3O2S/c1-26-15-3-9-22-10-7-18(8-11-22)23-12-5-17(6-13-23)20(24)21-16-19-4-2-14-25-19/h17-19H,2-16H2,1H3,(H,21,24)/p+2/t19-/m1/s1