1-[6,8-bis(chloranyl)benzo[e][1]benzothiol-4-yl]-2-piperidin-1-yl-ethanol hydrochloride

Systemtic Name: 1-[6,8-bis(chloranyl)benzo[e][1]benzothiol-4-yl]-2-piperidin-1-yl-ethanol hydrochloride Openeye Name: 1-(6,8-dichlorobenzo[e]benzothiophen-4-yl)-2-(1-piperidyl)ethanol hydrochloride CAS Name: 1-(6,8-dichloro-4-benzo[e][1]benzothiolyl)-2-(1-piperidinyl)ethanol hydrochloride IUPAC Name: 1-(6,8-dichlorobenzo[e][1]benzothiol-4-yl)-2-piperidin-1-ylethanol hydrochloride Traditional Name: 1-(6,8-dichlorobenzo[e]benzothiophen-4-yl)-2-piperidino-ethanol hydrochloride Formula: C19H20Cl3NOS MolecularWeight: 416.7922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(C2=C3C(=C4C=C(C=C(C4=C2)Cl)Cl)C=CS3)O.Cl

Isomeric SMILES

C1CCN(CC1)CC(C2=C3C(=C4C=C(C=C(C4=C2)Cl)Cl)C=CS3)O.Cl

InChI

InChI=1S/C19H19Cl2NOS.ClH/c20-12-8-14-13-4-7-24-19(13)16(10-15(14)17(21)9-12)18(23)11-22-5-2-1-3-6-22;/h4,7-10,18,23H,1-3,5-6,11H2;1H