1-(azepan-1-yl)-3-[3-[[(2-chlorophenyl)methylamino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[3-[[(2-chlorophenyl)methylamino]methyl]phenoxy]propan-2-ol Openeye Name: 1-(azepan-1-yl)-3-[3-[[(2-chlorophenyl)methylamino]methyl]phenoxy]propan-2-ol CAS Name: 1-(1-azepanyl)-3-[3-[[(2-chlorophenyl)methylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[3-[[(2-chlorophenyl)methylamino]methyl]phenoxy]propan-2-ol Traditional Name: 1-(azepan-1-yl)-3-[3-[[(2-chlorobenzyl)amino]methyl]phenoxy]propan-2-ol Formula: C23H31ClN2O2 MolecularWeight: 402.95744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(COC2=CC=CC(=C2)CNCC3=CC=CC=C3Cl)O

Isomeric SMILES

C1CCCN(CC1)CC(COC2=CC=CC(=C2)CNCC3=CC=CC=C3Cl)O

InChI

InChI=1S/C23H31ClN2O2/c24-23-11-4-3-9-20(23)16-25-15-19-8-7-10-22(14-19)28-18-21(27)17-26-12-5-1-2-6-13-26/h3-4,7-11,14,21,25,27H,1-2,5-6,12-13,15-18H2