2-[1-azanyl-2-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanenitrile

Systemtic Name: 2-[1-azanyl-2-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]ethanenitrile Openeye Name: 2-[1-amino-2-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetonitrile CAS Name: 2-[1-amino-2-(1H-benzimidazol-2-yl)-1-piperidin-1-iumyl]acetonitrile IUPAC Name: 2-[1-amino-2-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetonitrile Traditional Name: 2-[1-amino-2-(1H-benzimidazol-2-yl)piperidin-1-ium-1-yl]acetonitrile Formula: C14H18N5+ MolecularWeight: 256.32622

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C(C1)C2=NC3=CC=CC=C3N2)(CC#N)N

Isomeric SMILES

C1CC[N+](C(C1)C2=NC3=CC=CC=C3N2)(CC#N)N

InChI

InChI=1S/C14H18N5/c15-8-10-19(16)9-4-3-7-13(19)14-17-11-5-1-2-6-12(11)18-14/h1-2,5-6,13H,3-4,7,9-10,16H2,(H,17,18)/q+1