4-[2-[1-(4-bromanyl-2,6-dimethyl-phenoxy)propan-2-ylamino]ethyl]-2-methoxy-phenol hydrochloride

Systemtic Name: 4-[2-[1-(4-bromanyl-2,6-dimethyl-phenoxy)propan-2-ylamino]ethyl]-2-methoxy-phenol hydrochloride Openeye Name: 4-[2-[[2-(4-bromo-2,6-dimethyl-phenoxy)-1-methyl-ethyl]amino]ethyl]-2-methoxy-phenol hydrochloride CAS Name: 4-[2-[1-(4-bromo-2,6-dimethylphenoxy)propan-2-ylamino]ethyl]-2-methoxyphenol hydrochloride IUPAC Name: 4-[2-[1-(4-bromo-2,6-dimethylphenoxy)propan-2-ylamino]ethyl]-2-methoxyphenol hydrochloride Traditional Name: 4-[2-[[2-(4-bromo-2,6-dimethyl-phenoxy)-1-methyl-ethyl]amino]ethyl]-2-methoxy-phenol hydrochloride Formula: C20H27BrClNO3 MolecularWeight: 444.79028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(C)NCCC2=CC(=C(C=C2)O)OC)C)Br.Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(C)NCCC2=CC(=C(C=C2)O)OC)C)Br.Cl

InChI

InChI=1S/C20H26BrNO3.ClH/c1-13-9-17(21)10-14(2)20(13)25-12-15(3)22-8-7-16-5-6-18(23)19(11-16)24-4;/h5-6,9-11,15,22-23H,7-8,12H2,1-4H3;1H