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

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-[(2-methoxyphenyl)methyl]benzimidazole Openeye Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-[(2-methoxyphenyl)methyl]benzimidazole CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-1-[(2-methoxyphenyl)methyl]benzimidazole IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-[(2-methoxyphenyl)methyl]benzimidazole Traditional Name: 1-o-anisyl-2-[(4-piperonylpiperazino)methyl]benzimidazole Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C3=CC=CC=C3N=C2CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

COC1=CC=CC=C1CN2C3=CC=CC=C3N=C2CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H30N4O3/c1-33-25-9-5-2-6-22(25)18-32-24-8-4-3-7-23(24)29-28(32)19-31-14-12-30(13-15-31)17-21-10-11-26-27(16-21)35-20-34-26/h2-11,16H,12-15,17-20H2,1H3