4-methylbenzenesulfonate; 2-(1-methylpiperidin-1-ium-1-yl)ethanol

Systemtic Name: 4-methylbenzenesulfonate; 2-(1-methylpiperidin-1-ium-1-yl)ethanol Openeye Name: 4-methylbenzenesulfonate; 2-(1-methylpiperidin-1-ium-1-yl)ethanol CAS Name: 4-methylbenzenesulfonate; 2-(1-methyl-1-piperidin-1-iumyl)ethanol IUPAC Name: 4-methylbenzenesulfonate; 2-(1-methylpiperidin-1-ium-1-yl)ethanol Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)ethanol tosylate Formula: C15H25NO4S MolecularWeight: 315.4283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CCCCC1)CCO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1(CCCCC1)CCO

InChI

InChI=1S/C8H18NO.C7H8O3S/c1-9(7-8-10)5-3-2-4-6-9;1-6-2-4-7(5-3-6)11(8,9)10/h10H,2-8H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1