(1,3-dimethylpiperidin-4-yl) 4-methylbenzenesulfonate hydrochloride

Systemtic Name: (1,3-dimethylpiperidin-4-yl) 4-methylbenzenesulfonate hydrochloride Openeye Name: (1,3-dimethyl-4-piperidyl) 4-methylbenzenesulfonate hydrochloride CAS Name: 4-methylbenzenesulfonic acid (1,3-dimethyl-4-piperidinyl) ester hydrochloride IUPAC Name: (1,3-dimethylpiperidin-4-yl) 4-methylbenzenesulfonate hydrochloride Traditional Name: 4-methylbenzenesulfonic acid (1,3-dimethyl-4-piperidyl) ester hydrochloride Formula: C14H22ClNO3S MolecularWeight: 319.84738

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1OS(=O)(=O)C2=CC=C(C=C2)C)C.Cl

Isomeric SMILES

CC1CN(CCC1OS(=O)(=O)C2=CC=C(C=C2)C)C.Cl

InChI

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