4-methylbenzenesulfonate; 2-methylpyridine

Systemtic Name: 4-methylbenzenesulfonate; 2-methylpyridine Openeye Name: 4-methylbenzenesulfonate; 2-methylpyridine CAS Name: 4-methylbenzenesulfonate; 2-methylpyridine IUPAC Name: 4-methylbenzenesulfonate; 2-methylpyridine Traditional Name: $a-picoline tosylate Formula: C13H14NO3S- MolecularWeight: 264.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=CC=N1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=CC=N1

InChI

InChI=1S/C7H8O3S.C6H7N/c1-6-2-4-7(5-3-6)11(8,9)10;1-6-4-2-3-5-7-6/h2-5H,1H3,(H,8,9,10);2-5H,1H3/p-1