(2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-pentyl-propanamide

Systemtic Name: (2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-pentyl-propanamide Openeye Name: (2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-pentyl-propanamide CAS Name: (2S)-2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-N-pentylpropanamide IUPAC Name: (2S)-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-pentylpropanamide Traditional Name: (2S)-N-amyl-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]propionamide Formula: C17H36N3O+ MolecularWeight: 298.48724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C)NCCC[NH+]1CCCCC1C

Isomeric SMILES

CCCCCNC(=O)[C@H](C)NCCC[NH+]1CCCC[C@@H]1C

InChI

InChI=1S/C17H35N3O/c1-4-5-7-11-19-17(21)16(3)18-12-9-14-20-13-8-6-10-15(20)2/h15-16,18H,4-14H2,1-3H3,(H,19,21)/p+1/t15-,16-/m0/s1