3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol hydrochloride

Systemtic Name: 3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol hydrochloride Openeye Name: 3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol hydrochloride CAS Name: 3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol hydrochloride IUPAC Name: 3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)-1-benzothiophen-6-ol hydrochloride Traditional Name: 3-[4-(2-dimethylaminoethyloxy)phenoxy]-2-(4-hydroxyphenyl)benzothiophen-6-ol hydrochloride Formula: C24H24ClNO4S MolecularWeight: 457.96966

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O.Cl

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)OC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O.Cl

InChI

InChI=1S/C24H23NO4S.ClH/c1-25(2)13-14-28-19-8-10-20(11-9-19)29-23-21-12-7-18(27)15-22(21)30-24(23)16-3-5-17(26)6-4-16;/h3-12,15,26-27H,13-14H2,1-2H3;1H