2-(1-benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-(2-piperidin-1-ylethoxy)phenol hydrochloride

Systemtic Name: 2-(1-benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-(2-piperidin-1-ylethoxy)phenol hydrochloride Openeye Name: 2-(benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-[2-(1-piperidyl)ethoxy]phenol hydrochloride CAS Name: 2-(1-benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-[2-(1-piperidinyl)ethoxy]phenol hydrochloride IUPAC Name: 2-(1-benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-(2-piperidin-1-ylethoxy)phenol hydrochloride Traditional Name: 2-(benzothiophen-3-ylmethyl)-3-(4-hydroxyphenyl)-5-(2-piperidinoethoxy)phenol hydrochloride Formula: C28H30ClNO3S MolecularWeight: 496.0607

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)CC4=CSC5=CC=CC=C54)O.Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC(=C(C(=C2)C3=CC=C(C=C3)O)CC4=CSC5=CC=CC=C54)O.Cl

InChI

InChI=1S/C28H29NO3S.ClH/c30-22-10-8-20(9-11-22)25-17-23(32-15-14-29-12-4-1-5-13-29)18-27(31)26(25)16-21-19-33-28-7-3-2-6-24(21)28;/h2-3,6-11,17-19,30-31H,1,4-5,12-16H2;1H