1-(azepan-1-yl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[3-[[2-(1H-benzimidazol-2-yl)ethylamino]methyl]phenoxy]propan-2-ol Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(COC2=CC=CC(=C2)CNCCC3=NC4=CC=CC=C4N3)O

Isomeric SMILES

C1CCCN(CC1)CC(COC2=CC=CC(=C2)CNCCC3=NC4=CC=CC=C4N3)O

InChI

InChI=1S/C25H34N4O2/c30-21(18-29-14-5-1-2-6-15-29)19-31-22-9-7-8-20(16-22)17-26-13-12-25-27-23-10-3-4-11-24(23)28-25/h3-4,7-11,16,21,26,30H,1-2,5-6,12-15,17-19H2,(H,27,28)