[(2S)-3-ethyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]pentan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S)-3-ethyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]pentan-2-yl]-dimethyl-azanium Openeye Name: [(1S)-2-ethyl-1-[[(1-propylpiperidin-1-ium-4-yl)amino]methyl]butyl]-dimethyl-ammonium CAS Name: [(2S)-3-ethyl-1-[(1-propyl-4-piperidin-1-iumyl)amino]pentan-2-yl]-dimethylammonium IUPAC Name: [(2S)-3-ethyl-1-[(1-propylpiperidin-1-ium-4-yl)amino]pentan-2-yl]-dimethylazanium Traditional Name: [(1S)-2-ethyl-1-[[(1-propylpiperidin-1-ium-4-yl)amino]methyl]butyl]-dimethyl-ammonium Formula: C17H39N3+2 MolecularWeight: 285.51166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NCC(C(CC)CC)[NH+](C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC[C@H](C(CC)CC)[NH+](C)C

InChI

InChI=1S/C17H37N3/c1-6-11-20-12-9-16(10-13-20)18-14-17(19(4)5)15(7-2)8-3/h15-18H,6-14H2,1-5H3/p+2/t17-/m1/s1