1-(azepan-1-yl)-3-[3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[3-[[ethyl(4-pyridylmethyl)amino]methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[3-[[ethyl(pyridin-4-ylmethyl)amino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[3-[[ethyl(4-pyridylmethyl)amino]methyl]phenoxy]propan-2-ol Formula: C24H35N3O2 MolecularWeight: 397.5536

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)CC2=CC(=CC=C2)OCC(CN3CCCCCC3)O

Isomeric SMILES

CCN(CC1=CC=NC=C1)CC2=CC(=CC=C2)OCC(CN3CCCCCC3)O

InChI

InChI=1S/C24H35N3O2/c1-2-26(17-21-10-12-25-13-11-21)18-22-8-7-9-24(16-22)29-20-23(28)19-27-14-5-3-4-6-15-27/h7-13,16,23,28H,2-6,14-15,17-20H2,1H3