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4-methylbenzenesulfonate; tributylazanium

4-methylbenzenesulfonate; tributylazanium

Systemtic Name:4-methylbenzenesulfonate; tributylazanium
Openeye Name:4-methylbenzenesulfonate; tributylammonium
CAS Name:4-methylbenzenesulfonate; tributylammonium
IUPAC Name:4-methylbenzenesulfonate; tributylazanium
Traditional Name:tributylammonium tosylate
Formula: C19H35NO3S
MolecularWeight: 357.5511
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]


Isomeric SMILES

CCCC[NH+](CCCC)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]


InChI

InChI=1S/C12H27N.C7H8O3S/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-12H2,1-3H3;2-5H,1H3,(H,8,9,10)


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