2-(4-hydroxyphenyl)-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol hydrochloride

Systemtic Name: 2-(4-hydroxyphenyl)-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol hydrochloride Openeye Name: 2-(4-hydroxyphenyl)-3-[[4-[3-(1-piperidyl)propoxy]phenyl]methyl]benzothiophen-6-ol hydrochloride CAS Name: 2-(4-hydroxyphenyl)-3-[[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1-benzothiophen-6-ol hydrochloride IUPAC Name: 2-(4-hydroxyphenyl)-3-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]-1-benzothiophen-6-ol hydrochloride Traditional Name: 2-(4-hydroxyphenyl)-3-[4-(3-piperidinopropoxy)benzyl]benzothiophen-6-ol hydrochloride Formula: C29H32ClNO3S MolecularWeight: 510.08728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O.Cl

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O.Cl

InChI

InChI=1S/C29H31NO3S.ClH/c31-23-9-7-22(8-10-23)29-27(26-14-11-24(32)20-28(26)34-29)19-21-5-12-25(13-6-21)33-18-4-17-30-15-2-1-3-16-30;/h5-14,20,31-32H,1-4,15-19H2;1H