(2R)-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pentanedinitrile

Systemtic Name: (2R)-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pentanedinitrile Openeye Name: (2R)-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pentanedinitrile CAS Name: (2R)-2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: (2R)-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]pentanedinitrile Traditional Name: (2R)-2-[(4-pyridin-1-ium-2-ylpiperazino)methyl]glutaronitrile Formula: C15H20N5+ MolecularWeight: 270.3528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CCC#N)C#N)C2=CC=CC=[NH+]2

Isomeric SMILES

C1CN(CCN1C[C@@H](CCC#N)C#N)C2=CC=CC=[NH+]2

InChI

InChI=1S/C15H19N5/c16-6-3-4-14(12-17)13-19-8-10-20(11-9-19)15-5-1-2-7-18-15/h1-2,5,7,14H,3-4,8-11,13H2/p+1/t14-/m0/s1