3-[[1-(4,5,6-trimethoxy-1-oxidanyl-2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[[1-(4,5,6-trimethoxy-1-oxidanyl-2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-1H-benzimidazol-2-one Openeye Name: 3-[[1-(1-hydroxy-4,5,6-trimethoxy-indan-2-yl)-4-piperidyl]methyl]-1H-benzimidazol-2-one CAS Name: 3-[[1-(1-hydroxy-4,5,6-trimethoxy-2,3-dihydro-1H-inden-2-yl)-4-piperidinyl]methyl]-1H-benzimidazol-2-one IUPAC Name: 3-[[1-(1-hydroxy-4,5,6-trimethoxy-2,3-dihydro-1H-inden-2-yl)piperidin-4-yl]methyl]-1H-benzimidazol-2-one Traditional Name: 3-[[1-(1-hydroxy-4,5,6-trimethoxy-indan-2-yl)-4-piperidyl]methyl]-1H-benzimidazol-2-one Formula: C25H31N3O5 MolecularWeight: 453.53074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2CC(C(C2=C1)O)N3CCC(CC3)CN4C5=CC=CC=C5NC4=O)OC)OC

Isomeric SMILES

COC1=C(C(=C2CC(C(C2=C1)O)N3CCC(CC3)CN4C5=CC=CC=C5NC4=O)OC)OC

InChI

InChI=1S/C25H31N3O5/c1-31-21-13-16-17(23(32-2)24(21)33-3)12-20(22(16)29)27-10-8-15(9-11-27)14-28-19-7-5-4-6-18(19)26-25(28)30/h4-7,13,15,20,22,29H,8-12,14H2,1-3H3,(H,26,30)