3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propylazanium

Systemtic Name: 3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propylazanium Openeye Name: 3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propylammonium CAS Name: 3-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]propylammonium IUPAC Name: 3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propylazanium Traditional Name: 3-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propylammonium Formula: C12H23N4+3 MolecularWeight: 223.33782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC[NH3+])C2=CC=CC=[NH+]2

Isomeric SMILES

C1CN(CC[NH+]1CCC[NH3+])C2=CC=CC=[NH+]2

InChI

InChI=1S/C12H20N4/c13-5-3-7-15-8-10-16(11-9-15)12-4-1-2-6-14-12/h1-2,4,6H,3,5,7-11,13H2/p+3