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

Systemtic Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(1-phenylethyl)benzimidazole Openeye Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(1-phenylethyl)benzimidazole CAS Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-1-(1-phenylethyl)benzimidazole IUPAC Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-1-(1-phenylethyl)benzimidazole Traditional Name: 1-(1-phenylethyl)-2-[(4-piperonylpiperazino)methyl]benzimidazole Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C3=CC=CC=C3N=C2CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC(C1=CC=CC=C1)N2C3=CC=CC=C3N=C2CN4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H30N4O2/c1-21(23-7-3-2-4-8-23)32-25-10-6-5-9-24(25)29-28(32)19-31-15-13-30(14-16-31)18-22-11-12-26-27(17-22)34-20-33-26/h2-12,17,21H,13-16,18-20H2,1H3