2-acetyloxy-5-propyl-benzenesulfonic acid

Systemtic Name: 2-acetyloxy-5-propyl-benzenesulfonic acid Openeye Name: 2-acetoxy-5-propyl-benzenesulfonic acid CAS Name: 2-acetyloxy-5-propylbenzenesulfonic acid IUPAC Name: 2-acetyloxy-5-propylbenzenesulfonic acid Traditional Name: 2-acetoxy-5-propyl-besylic acid Formula: C11H14O5S MolecularWeight: 258.29086

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)OC(=O)C)S(=O)(=O)O

Isomeric SMILES

CCCC1=CC(=C(C=C1)OC(=O)C)S(=O)(=O)O

InChI

InChI=1S/C11H14O5S/c1-3-4-9-5-6-10(16-8(2)12)11(7-9)17(13,14)15/h5-7H,3-4H2,1-2H3,(H,13,14,15)