(2S)-2-ethyl-N-[(3S)-piperidin-1-ium-3-yl]hexanamide

Systemtic Name: (2S)-2-ethyl-N-[(3S)-piperidin-1-ium-3-yl]hexanamide Openeye Name: (2S)-2-ethyl-N-[(3S)-piperidin-1-ium-3-yl]hexanamide CAS Name: (2S)-2-ethyl-N-[(3S)-3-piperidin-1-iumyl]hexanamide IUPAC Name: (2S)-2-ethyl-N-[(3S)-piperidin-1-ium-3-yl]hexanamide Traditional Name: (2S)-2-ethyl-N-[(3S)-piperidin-1-ium-3-yl]hexanamide Formula: C13H27N2O+ MolecularWeight: 227.36628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1CCC[NH2+]C1

Isomeric SMILES

CCCC[C@H](CC)C(=O)N[C@H]1CCC[NH2+]C1

InChI

InChI=1S/C13H26N2O/c1-3-5-7-11(4-2)13(16)15-12-8-6-9-14-10-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)/p+1/t11-,12-/m0/s1