2-methyl-1-(phenylmethyl)-4-piperidin-4-yl-1-(pyridin-3-ylmethyl)benzimidazol-1-ium

Systemtic Name: 2-methyl-1-(phenylmethyl)-4-piperidin-4-yl-1-(pyridin-3-ylmethyl)benzimidazol-1-ium Openeye Name: 1-benzyl-2-methyl-4-(4-piperidyl)-1-(3-pyridylmethyl)benzimidazol-1-ium CAS Name: 2-methyl-1-(phenylmethyl)-4-(4-piperidinyl)-1-(3-pyridinylmethyl)benzimidazol-1-ium IUPAC Name: 1-benzyl-2-methyl-4-piperidin-4-yl-1-(pyridin-3-ylmethyl)benzimidazol-1-ium Traditional Name: 1-benzyl-2-methyl-4-(4-piperidyl)-1-(3-pyridylmethyl)benzimidazol-1-ium Formula: C26H29N4+ MolecularWeight: 397.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2[N+]1(CC3=CC=CC=C3)CC4=CN=CC=C4)C5CCNCC5

Isomeric SMILES

CC1=NC2=C(C=CC=C2[N+]1(CC3=CC=CC=C3)CC4=CN=CC=C4)C5CCNCC5

InChI

InChI=1S/C26H29N4/c1-20-29-26-24(23-12-15-27-16-13-23)10-5-11-25(26)30(20,18-21-7-3-2-4-8-21)19-22-9-6-14-28-17-22/h2-11,14,17,23,27H,12-13,15-16,18-19H2,1H3/q+1