[(2R)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium

Systemtic Name: [(2R)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium Openeye Name: [(2R)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]ammonium CAS Name: [(2R)-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]butyl]ammonium IUPAC Name: [(2R)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)butyl]azanium Traditional Name: [(2R)-2-(4-pyridin-1-ium-2-ylpiperazino)butyl]ammonium Formula: C13H24N4+2 MolecularWeight: 236.35646

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH3+])N1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

CC[C@H](C[NH3+])N1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C13H22N4/c1-2-12(11-14)16-7-9-17(10-8-16)13-5-3-4-6-15-13/h3-6,12H,2,7-11,14H2,1H3/p+2/t12-/m1/s1