2-acetyloxy-5-hexyl-benzenesulfonic acid

Systemtic Name: 2-acetyloxy-5-hexyl-benzenesulfonic acid Openeye Name: 2-acetoxy-5-hexyl-benzenesulfonic acid CAS Name: 2-acetyloxy-5-hexylbenzenesulfonic acid IUPAC Name: 2-acetyloxy-5-hexylbenzenesulfonic acid Traditional Name: 2-acetoxy-5-hexyl-besylic acid Formula: C14H20O5S MolecularWeight: 300.3706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)OC(=O)C)S(=O)(=O)O

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)OC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C14H20O5S/c1-3-4-5-6-7-12-8-9-13(19-11(2)15)14(10-12)20(16,17)18/h8-10H,3-7H2,1-2H3,(H,16,17,18)