2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(pyridin-4-ylmethyl)benzimidazole

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(pyridin-4-ylmethyl)benzimidazole Openeye Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(4-pyridylmethyl)benzimidazole CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-1-(pyridin-4-ylmethyl)benzimidazole IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(pyridin-4-ylmethyl)benzimidazole Traditional Name: 2-[(4-piperonylpiperazino)methyl]-1-(4-pyridylmethyl)benzimidazole Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=NC5=CC=CC=C5N4CC6=CC=NC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=NC5=CC=CC=C5N4CC6=CC=NC=C6

InChI

InChI=1S/C26H27N5O2/c1-2-4-23-22(3-1)28-26(31(23)17-20-7-9-27-10-8-20)18-30-13-11-29(12-14-30)16-21-5-6-24-25(15-21)33-19-32-24/h1-10,15H,11-14,16-19H2