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

Systemtic Name: 1-(azepan-1-yl)-3-[3-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[3-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[3-[[methyl(2-pyrazinylmethyl)amino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[3-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[3-[[methyl(pyrazin-2-ylmethyl)amino]methyl]phenoxy]propan-2-ol Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OCC(CN2CCCCCC2)O)CC3=NC=CN=C3

Isomeric SMILES

CN(CC1=CC(=CC=C1)OCC(CN2CCCCCC2)O)CC3=NC=CN=C3

InChI

InChI=1S/C22H32N4O2/c1-25(16-20-14-23-9-10-24-20)15-19-7-6-8-22(13-19)28-18-21(27)17-26-11-4-2-3-5-12-26/h6-10,13-14,21,27H,2-5,11-12,15-18H2,1H3