4-methylbenzenesulfonate; octylazanium

Systemtic Name: 4-methylbenzenesulfonate; octylazanium Openeye Name: 4-methylbenzenesulfonate; octylammonium CAS Name: 4-methylbenzenesulfonate; octylammonium IUPAC Name: 4-methylbenzenesulfonate; octylazanium Traditional Name: octylammonium tosylate Formula: C15H27NO3S MolecularWeight: 301.44478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[NH3+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCC[NH3+].CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C8H19N.C7H8O3S/c1-2-3-4-5-6-7-8-9;1-6-2-4-7(5-3-6)11(8,9)10/h2-9H2,1H3;2-5H,1H3,(H,8,9,10)