4-methylbenzenesulfonate; trimethyl(4-oxidanylbut-2-ynyl)azanium

Systemtic Name: 4-methylbenzenesulfonate; trimethyl(4-oxidanylbut-2-ynyl)azanium Openeye Name: 4-hydroxybut-2-ynyl(trimethyl)ammonium; 4-methylbenzenesulfonate CAS Name: 4-hydroxybut-2-ynyl(trimethyl)ammonium; 4-methylbenzenesulfonate IUPAC Name: 4-hydroxybut-2-ynyl(trimethyl)azanium; 4-methylbenzenesulfonate Traditional Name: 4-hydroxybut-2-ynyl(trimethyl)ammonium tosylate Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H14NO.C7H8O3S/c1-8(2,3)6-4-5-7-9;1-6-2-4-7(5-3-6)11(8,9)10/h9H,6-7H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1