2,3-bis(oxidanyl)-4-oxidanylidene-4-(2-phenethyloxyethylsulfonyloxy)butanoic acid

Systemtic Name: 2,3-bis(oxidanyl)-4-oxidanylidene-4-(2-phenethyloxyethylsulfonyloxy)butanoic acid Openeye Name: 2,3-dihydroxy-4-oxo-4-(2-phenethyloxyethylsulfonyloxy)butanoic acid CAS Name: 2,3-dihydroxy-4-oxo-4-(2-phenethyloxyethylsulfonyloxy)butanoic acid IUPAC Name: 2,3-dihydroxy-4-oxo-4-(2-phenethyloxyethylsulfonyloxy)butanoic acid Traditional Name: 2,3-dihydroxy-4-keto-4-(2-phenethyloxyethylsulfonyloxy)butyric acid Formula: C14H18O9S MolecularWeight: 362.35232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOCCS(=O)(=O)OC(=O)C(C(C(=O)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOCCS(=O)(=O)OC(=O)C(C(C(=O)O)O)O

InChI

InChI=1S/C14H18O9S/c15-11(13(17)18)12(16)14(19)23-24(20,21)9-8-22-7-6-10-4-2-1-3-5-10/h1-5,11-12,15-16H,6-9H2,(H,17,18)