3-[4-(2-bromanylphenoxy)-3-oxidanyl-1-piperidin-3-yl-butyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[4-(2-bromanylphenoxy)-3-oxidanyl-1-piperidin-3-yl-butyl]-1H-benzimidazol-2-one Openeye Name: 3-[4-(2-bromophenoxy)-3-hydroxy-1-(3-piperidyl)butyl]-1H-benzimidazol-2-one CAS Name: 3-[4-(2-bromophenoxy)-3-hydroxy-1-(3-piperidinyl)butyl]-1H-benzimidazol-2-one IUPAC Name: 3-[4-(2-bromophenoxy)-3-hydroxy-1-piperidin-3-ylbutyl]-1H-benzimidazol-2-one Traditional Name: 3-[4-(2-bromophenoxy)-3-hydroxy-1-(3-piperidyl)butyl]-1H-benzimidazol-2-one Formula: C22H26BrN3O3 MolecularWeight: 460.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(CC(COC2=CC=CC=C2Br)O)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

C1CC(CNC1)C(CC(COC2=CC=CC=C2Br)O)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H26BrN3O3/c23-17-7-1-4-10-21(17)29-14-16(27)12-20(15-6-5-11-24-13-15)26-19-9-3-2-8-18(19)25-22(26)28/h1-4,7-10,15-16,20,24,27H,5-6,11-14H2,(H,25,28)