[4-acetyloxy-3-(5-piperidin-1-ylpentylsulfanyl)phenyl] ethanoate hydrochloride

Systemtic Name: [4-acetyloxy-3-(5-piperidin-1-ylpentylsulfanyl)phenyl] ethanoate hydrochloride Openeye Name: [4-acetoxy-3-[5-(1-piperidyl)pentylsulfanyl]phenyl] acetate hydrochloride CAS Name: acetic acid [4-acetyloxy-3-[5-(1-piperidinyl)pentylthio]phenyl] ester hydrochloride IUPAC Name: [4-acetyloxy-3-(5-piperidin-1-ylpentylsulfanyl)phenyl] acetate hydrochloride Traditional Name: acetic acid [4-acetoxy-3-(5-piperidinopentylthio)phenyl] ester hydrochloride Formula: C20H30ClNO4S MolecularWeight: 415.9745

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C=C1)OC(=O)C)SCCCCCN2CCCCC2.Cl

Isomeric SMILES

CC(=O)OC1=CC(=C(C=C1)OC(=O)C)SCCCCCN2CCCCC2.Cl

InChI

InChI=1S/C20H29NO4S.ClH/c1-16(22)24-18-9-10-19(25-17(2)23)20(15-18)26-14-8-4-7-13-21-11-5-3-6-12-21;/h9-10,15H,3-8,11-14H2,1-2H3;1H