1-(2-methylpropyl)-4-piperidin-1-ium-4-yl-piperazin-1-ium

Systemtic Name: 1-(2-methylpropyl)-4-piperidin-1-ium-4-yl-piperazin-1-ium Openeye Name: 1-isobutyl-4-piperidin-1-ium-4-yl-piperazin-1-ium CAS Name: 1-(2-methylpropyl)-4-(4-piperidin-1-iumyl)piperazin-1-ium IUPAC Name: 1-(2-methylpropyl)-4-piperidin-1-ium-4-ylpiperazin-1-ium Traditional Name: 1-isobutyl-4-piperidin-1-ium-4-yl-piperazin-1-ium Formula: C13H29N3+2 MolecularWeight: 227.38946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCN(CC1)C2CC[NH2+]CC2

Isomeric SMILES

CC(C)C[NH+]1CCN(CC1)C2CC[NH2+]CC2

InChI

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