4-methylbenzenesulfonate; 2-methylbutan-2-ylazanium; 2-methylprop-2-enoate

Systemtic Name: 4-methylbenzenesulfonate; 2-methylbutan-2-ylazanium; 2-methylprop-2-enoate Openeye Name: 1,1-dimethylpropylammonium; 4-methylbenzenesulfonate; 2-methylprop-2-enoate CAS Name: 4-methylbenzenesulfonate; 2-methylbutan-2-ylammonium; 2-methyl-2-propenoate IUPAC Name: 4-methylbenzenesulfonate; 2-methylbutan-2-ylazanium; 2-methylprop-2-enoate Traditional Name: tert-amylammonium; methacrylate; tosylate Formula: C16H26NO5S- MolecularWeight: 344.44634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C5H13N.C4H6O2/c1-6-2-4-7(5-3-6)11(8,9)10;1-4-5(2,3)6;1-3(2)4(5)6/h2-5H,1H3,(H,8,9,10);4,6H2,1-3H3;1H2,2H3,(H,5,6)/p-1