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

Systemtic Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-methyl-amino]ethanol hydrochloride Openeye Name: 2-[4-[3-(4-bromophenyl)benzothiophen-6-yl]oxybutyl-methyl-amino]ethanol hydrochloride CAS Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-methylamino]ethanol hydrochloride IUPAC Name: 2-[4-[[3-(4-bromophenyl)-1-benzothiophen-6-yl]oxy]butyl-methylamino]ethanol hydrochloride Traditional Name: 2-[4-[3-(4-bromophenyl)benzothiophen-6-yl]oxybutyl-methyl-amino]ethanol hydrochloride Formula: C21H25BrClNO2S MolecularWeight: 470.8507

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrNO2S.ClH/c1-23(11-12-24)10-2-3-13-25-18-8-9-19-20(15-26-21(19)14-18)16-4-6-17(22)7-5-16;/h4-9,14-15,24H,2-3,10-13H2,1H3;1H