2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-ethyl-amino]ethanol hydrochloride

Systemtic Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-ethyl-amino]ethanol hydrochloride Openeye Name: 2-[4-[3-(4-bromophenyl)benzothiophen-6-yl]oxybutyl-ethyl-amino]ethanol hydrochloride CAS Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-ethylamino]ethanol hydrochloride IUPAC Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-ethylamino]ethanol hydrochloride Traditional Name: 2-[4-[3-(4-bromophenyl)benzothiophen-6-yl]oxybutyl-ethyl-amino]ethanol hydrochloride Formula: C22H27BrClNO2S MolecularWeight: 484.87728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCOC1=CC2=C(C=C1)C(=CS2)C3=CC=C(C=C3)Br)CCO.Cl

Isomeric SMILES

CCN(CCCCOC1=CC2=C(C=C1)C(=CS2)C3=CC=C(C=C3)Br)CCO.Cl

InChI

InChI=1S/C22H26BrNO2S.ClH/c1-2-24(12-13-25)11-3-4-14-26-19-9-10-20-21(16-27-22(20)15-19)17-5-7-18(23)8-6-17;/h5-10,15-16,25H,2-4,11-14H2,1H3;1H