1-(2-azanylethyl)-4-piperidin-4-yl-1-(quinolin-4-ylmethyl)benzimidazol-1-ium-2-amine

Systemtic Name: 1-(2-azanylethyl)-4-piperidin-4-yl-1-(quinolin-4-ylmethyl)benzimidazol-1-ium-2-amine Openeye Name: 1-(2-aminoethyl)-4-(4-piperidyl)-1-(4-quinolylmethyl)benzimidazol-1-ium-2-amine CAS Name: 1-(2-aminoethyl)-4-(4-piperidinyl)-1-(4-quinolinylmethyl)-2-benzimidazol-1-iumamine IUPAC Name: 1-(2-aminoethyl)-4-piperidin-4-yl-1-(quinolin-4-ylmethyl)benzimidazol-1-ium-2-amine Traditional Name: [1-(2-aminoethyl)-4-(4-piperidyl)-1-(4-quinolylmethyl)benzimidazol-1-ium-2-yl]amine Formula: C24H29N6+ MolecularWeight: 401.52726

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C3C(=CC=C2)[N+](C(=N3)N)(CCN)CC4=CC=NC5=CC=CC=C45

Isomeric SMILES

C1CNCCC1C2=C3C(=CC=C2)[N+](C(=N3)N)(CCN)CC4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C24H29N6/c25-11-15-30(16-18-10-14-28-21-6-2-1-4-19(18)21)22-7-3-5-20(23(22)29-24(30)26)17-8-12-27-13-9-17/h1-7,10,14,17,27H,8-9,11-13,15-16,25H2,(H2,26,29)/q+1