1-(3-piperidin-1-ylpropoxy)-6H-benzo[b][1]benzothiepin-5-one hydrochloride

Systemtic Name: 1-(3-piperidin-1-ylpropoxy)-6H-benzo[b][1]benzothiepin-5-one hydrochloride Openeye Name: 1-[3-(1-piperidyl)propoxy]-6H-benzo[b][1]benzothiepin-5-one hydrochloride CAS Name: 1-[3-(1-piperidinyl)propoxy]-6H-benzo[b][1]benzothiepin-5-one hydrochloride IUPAC Name: 1-(3-piperidin-1-ylpropoxy)-6H-benzo[b][1]benzothiepin-5-one hydrochloride Traditional Name: 1-(3-piperidinopropoxy)-6H-benzo[b][1]benzothiepin-5-one hydrochloride Formula: C22H26ClNO2S MolecularWeight: 403.96534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=CC3=C2SC4=CC=CC=C4CC3=O.Cl

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=CC3=C2SC4=CC=CC=C4CC3=O.Cl

InChI

InChI=1S/C22H25NO2S.ClH/c24-19-16-17-8-2-3-11-21(17)26-22-18(19)9-6-10-20(22)25-15-7-14-23-12-4-1-5-13-23;/h2-3,6,8-11H,1,4-5,7,12-16H2;1H