1-(azepan-1-yl)-3-(4-bromanylphenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-(azepan-1-yl)-3-(4-bromanylphenoxy)propan-2-ol hydrochloride Openeye Name: 1-(azepan-1-yl)-3-(4-bromophenoxy)propan-2-ol hydrochloride CAS Name: 1-(1-azepanyl)-3-(4-bromophenoxy)-2-propanol hydrochloride IUPAC Name: 1-(azepan-1-yl)-3-(4-bromophenoxy)propan-2-ol hydrochloride Traditional Name: 1-(azepan-1-yl)-3-(4-bromophenoxy)propan-2-ol hydrochloride Formula: C15H23BrClNO2 MolecularWeight: 364.70562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(COC2=CC=C(C=C2)Br)O.Cl

Isomeric SMILES

C1CCCN(CC1)CC(COC2=CC=C(C=C2)Br)O.Cl

InChI

InChI=1S/C15H22BrNO2.ClH/c16-13-5-7-15(8-6-13)19-12-14(18)11-17-9-3-1-2-4-10-17;/h5-8,14,18H,1-4,9-12H2;1H