3-(4-ethylsulfonyl-1-methyl-piperidin-4-yl)phenol ethanoate hydrochloride

Systemtic Name: 3-(4-ethylsulfonyl-1-methyl-piperidin-4-yl)phenol ethanoate hydrochloride Openeye Name: 3-(4-ethylsulfonyl-1-methyl-4-piperidyl)phenol acetate hydrochloride CAS Name: 3-(4-ethylsulfonyl-1-methyl-4-piperidinyl)phenol acetate hydrochloride IUPAC Name: 3-(4-ethylsulfonyl-1-methylpiperidin-4-yl)phenol acetate hydrochloride Traditional Name: 3-(4-esyl-1-methyl-4-piperidyl)phenol acetate hydrochloride Formula: C16H25ClNO5S- MolecularWeight: 378.8914

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O.CC(=O)[O-].Cl

Isomeric SMILES

CCS(=O)(=O)C1(CCN(CC1)C)C2=CC(=CC=C2)O.CC(=O)[O-].Cl

InChI

InChI=1S/C14H21NO3S.C2H4O2.ClH/c1-3-19(17,18)14(7-9-15(2)10-8-14)12-5-4-6-13(16)11-12;1-2(3)4;/h4-6,11,16H,3,7-10H2,1-2H3;1H3,(H,3,4);1H/p-1