[2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-propyl-pentyl]azanium

Systemtic Name: [2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-propyl-pentyl]azanium Openeye Name: [2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-propyl-pentyl]ammonium CAS Name: [2-[(3S)-3-methyl-1-piperidin-1-iumyl]-2-propylpentyl]ammonium IUPAC Name: [2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-propylpentyl]azanium Traditional Name: [2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-propyl-pentyl]ammonium Formula: C14H32N2+2 MolecularWeight: 228.41728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C[NH3+])[NH+]1CCCC(C1)C

Isomeric SMILES

CCCC(CCC)(C[NH3+])[NH+]1CCC[C@@H](C1)C

InChI

InChI=1S/C14H30N2/c1-4-8-14(12-15,9-5-2)16-10-6-7-13(3)11-16/h13H,4-12,15H2,1-3H3/p+2/t13-/m0/s1