1-(2-azanylethyl)-4-methyl-5-piperidin-4-yl-1-(quinolin-8-ylmethyl)benzimidazol-1-ium-2-amine

Systemtic Name: 1-(2-azanylethyl)-4-methyl-5-piperidin-4-yl-1-(quinolin-8-ylmethyl)benzimidazol-1-ium-2-amine Openeye Name: 1-(2-aminoethyl)-4-methyl-5-(4-piperidyl)-1-(8-quinolylmethyl)benzimidazol-1-ium-2-amine CAS Name: 1-(2-aminoethyl)-4-methyl-5-(4-piperidinyl)-1-(8-quinolinylmethyl)-2-benzimidazol-1-iumamine IUPAC Name: 1-(2-aminoethyl)-4-methyl-5-piperidin-4-yl-1-(quinolin-8-ylmethyl)benzimidazol-1-ium-2-amine Traditional Name: [1-(2-aminoethyl)-4-methyl-5-(4-piperidyl)-1-(8-quinolylmethyl)benzimidazol-1-ium-2-yl]amine Formula: C25H31N6+ MolecularWeight: 415.55384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C([N+]2(CCN)CC3=CC=CC4=C3N=CC=C4)N)C5CCNCC5

Isomeric SMILES

CC1=C(C=CC2=C1N=C([N+]2(CCN)CC3=CC=CC4=C3N=CC=C4)N)C5CCNCC5

InChI

InChI=1S/C25H31N6/c1-17-21(18-9-13-28-14-10-18)7-8-22-23(17)30-25(27)31(22,15-11-26)16-20-5-2-4-19-6-3-12-29-24(19)20/h2-8,12,18,28H,9-11,13-16,26H2,1H3,(H2,27,30)/q+1