2-acetyloxy-4-(4-methylphenyl)sulfonyloxy-butanoic acid

Systemtic Name: 2-acetyloxy-4-(4-methylphenyl)sulfonyloxy-butanoic acid Openeye Name: 2-acetoxy-4-(p-tolylsulfonyloxy)butanoic acid CAS Name: 2-acetyloxy-4-(4-methylphenyl)sulfonyloxybutanoic acid IUPAC Name: 2-acetyloxy-4-(4-methylphenyl)sulfonyloxybutanoic acid Traditional Name: 2-acetoxy-4-tosyloxy-butyric acid Formula: C13H16O7S MolecularWeight: 316.32694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C(=O)O)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC(C(=O)O)OC(=O)C

InChI

InChI=1S/C13H16O7S/c1-9-3-5-11(6-4-9)21(17,18)19-8-7-12(13(15)16)20-10(2)14/h3-6,12H,7-8H2,1-2H3,(H,15,16)