3-methylbutyl(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: 3-methylbutyl(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: isopentyl(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: 3-methylbutyl-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: 3-methylbutyl(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: isoamyl(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH2+]CCC[NH+]1CCCCC1

Isomeric SMILES

CC(C)CC[NH2+]CCC[NH+]1CCCCC1

InChI

InChI=1S/C13H28N2/c1-13(2)7-9-14-8-6-12-15-10-4-3-5-11-15/h13-14H,3-12H2,1-2H3/p+2