2-phenyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol hydrochloride

Systemtic Name: 2-phenyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol hydrochloride Openeye Name: 2-phenyl-3-[4-[2-(1-piperidyl)ethoxy]phenoxy]benzothiophen-6-ol hydrochloride CAS Name: 2-phenyl-3-[4-[2-(1-piperidinyl)ethoxy]phenoxy]-1-benzothiophen-6-ol hydrochloride IUPAC Name: 2-phenyl-3-[4-(2-piperidin-1-ylethoxy)phenoxy]-1-benzothiophen-6-ol hydrochloride Traditional Name: 2-phenyl-3-[4-(2-piperidinoethoxy)phenoxy]benzothiophen-6-ol hydrochloride Formula: C27H28ClNO3S MolecularWeight: 482.03412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)OC3=C(SC4=C3C=CC(=C4)O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H27NO3S.ClH/c29-21-9-14-24-25(19-21)32-27(20-7-3-1-4-8-20)26(24)31-23-12-10-22(11-13-23)30-18-17-28-15-5-2-6-16-28;/h1,3-4,7-14,19,29H,2,5-6,15-18H2;1H