[(5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] benzoate

Systemtic Name: [(5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]-2-oxidanyl-4-oxidanylidene-furan-3-yl] benzoate Openeye Name: [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxo-3-furyl] benzoate CAS Name: benzoic acid [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxo-3-furanyl] ester IUPAC Name: [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-oxofuran-3-yl] benzoate Traditional Name: benzoic acid [(5R)-5-[(1S)-1,2-dihydroxyethyl]-2-hydroxy-4-keto-3-furyl] ester Formula: C13H12O7 MolecularWeight: 280.23018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C(OC(C2=O)C(CO)O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C(O[C@@H](C2=O)[C@H](CO)O)O

InChI

InChI=1S/C13H12O7/c14-6-8(15)10-9(16)11(13(18)19-10)20-12(17)7-4-2-1-3-5-7/h1-5,8,10,14-15,18H,6H2/t8-,10+/m0/s1