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

Systemtic Name: 2,3-bis(oxidanyl)-4-oxidanylidene-3-(phenylcarbonyl)-4-(phenylcarbonyloxy)butanoic acid Openeye Name: 3-benzoyl-4-benzoyloxy-2,3-dihydroxy-4-oxo-butanoic acid CAS Name: 3-benzoyl-4-benzoyloxy-2,3-dihydroxy-4-oxobutanoic acid IUPAC Name: 3-benzoyl-4-benzoyloxy-2,3-dihydroxy-4-oxobutanoic acid Traditional Name: 3-benzoyl-4-benzoyloxy-2,3-dihydroxy-4-keto-butyric acid Formula: C18H14O8 MolecularWeight: 358.29896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)(C(=O)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)(C(=O)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C18H14O8/c19-13(11-7-3-1-4-8-11)18(25,14(20)15(21)22)17(24)26-16(23)12-9-5-2-6-10-12/h1-10,14,20,25H,(H,21,22)