1-[(2S)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2S)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-yl]piperazin-4-ium Openeye Name: 1-[(1S)-1-methyl-2-(4-methylpiperidin-1-ium-1-yl)ethyl]piperazin-4-ium CAS Name: 1-[(2S)-1-(4-methyl-1-piperidin-1-iumyl)propan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2S)-1-(4-methylpiperidin-1-ium-1-yl)propan-2-yl]piperazin-4-ium Traditional Name: 1-[(1S)-1-methyl-2-(4-methylpiperidin-1-ium-1-yl)ethyl]piperazin-4-ium Formula: C13H29N3+2 MolecularWeight: 227.38946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(C)N2CC[NH2+]CC2

Isomeric SMILES

CC1CC[NH+](CC1)C[C@H](C)N2CC[NH2+]CC2

InChI

InChI=1S/C13H27N3/c1-12-3-7-15(8-4-12)11-13(2)16-9-5-14-6-10-16/h12-14H,3-11H2,1-2H3/p+2/t13-/m0/s1