methyl 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxylate

Systemtic Name: methyl 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxylate Openeye Name: methyl 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxylate CAS Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazinyl]butyl]-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-yl]butyl]benzimidazole-5-carboxylate Traditional Name: 1-[4-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazino]butyl]benzimidazole-5-carboxylic acid methyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=N2)CCCCN3CCN(CC3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=N2)CCCCN3CCN(CC3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H30N4O4/c1-31-25(30)19-4-6-22-21(16-19)26-18-29(22)9-3-2-8-27-10-12-28(13-11-27)20-5-7-23-24(17-20)33-15-14-32-23/h4-7,16-18H,2-3,8-15H2,1H3