4-methylbenzenesulfonate; methyl(propyl)azanium

Systemtic Name: 4-methylbenzenesulfonate; methyl(propyl)azanium Openeye Name: 4-methylbenzenesulfonate; methyl(propyl)ammonium CAS Name: 4-methylbenzenesulfonate; methyl(propyl)ammonium IUPAC Name: 4-methylbenzenesulfonate; methyl(propyl)azanium Traditional Name: methyl(propyl)ammonium tosylate Formula: C11H19NO3S MolecularWeight: 245.33846

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCC[NH2+]C.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C7H8O3S.C4H11N/c1-6-2-4-7(5-3-6)11(8,9)10;1-3-4-5-2/h2-5H,1H3,(H,8,9,10);5H,3-4H2,1-2H3