1-(azepan-1-yl)-3-[2-methoxy-4-[[(2-methylphenyl)methylamino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[[(2-methylphenyl)methylamino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[(o-tolylmethylamino)methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[2-methoxy-4-[[(2-methylphenyl)methylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[[(2-methylphenyl)methylamino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[[(2-methylbenzyl)amino]methyl]phenoxy]propan-2-ol Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNCC2=CC(=C(C=C2)OCC(CN3CCCCCC3)O)OC

Isomeric SMILES

CC1=CC=CC=C1CNCC2=CC(=C(C=C2)OCC(CN3CCCCCC3)O)OC

InChI

InChI=1S/C25H36N2O3/c1-20-9-5-6-10-22(20)17-26-16-21-11-12-24(25(15-21)29-2)30-19-23(28)18-27-13-7-3-4-8-14-27/h5-6,9-12,15,23,26,28H,3-4,7-8,13-14,16-19H2,1-2H3