1-(2-piperidin-1-ium-1-ylethyl)-3-prop-2-enyl-benzimidazol-3-ium-2-amine

Systemtic Name: 1-(2-piperidin-1-ium-1-ylethyl)-3-prop-2-enyl-benzimidazol-3-ium-2-amine Openeye Name: 1-allyl-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-2-amine CAS Name: 1-[2-(1-piperidin-1-iumyl)ethyl]-3-prop-2-enyl-2-benzimidazol-3-iumamine IUPAC Name: 1-(2-piperidin-1-ium-1-ylethyl)-3-prop-2-enylbenzimidazol-3-ium-2-amine Traditional Name: [1-allyl-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-2-yl]amine Formula: C17H26N4+2 MolecularWeight: 286.41514

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(N(C2=CC=CC=C21)CC[NH+]3CCCCC3)N

Isomeric SMILES

C=CC[N+]1=C(N(C2=CC=CC=C21)CC[NH+]3CCCCC3)N

InChI

InChI=1S/C17H24N4/c1-2-10-20-15-8-4-5-9-16(15)21(17(20)18)14-13-19-11-6-3-7-12-19/h2,4-5,8-9,18H,1,3,6-7,10-14H2/p+2