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

Systemtic Name: [(2S)-2-[(2R)-4,5-bis(oxidanyl)-3-oxidanylidene-furan-2-yl]-2-oxidanyl-ethyl] 4-methoxybenzoate Openeye Name: [(2S)-2-[(2R)-4,5-dihydroxy-3-oxo-2-furyl]-2-hydroxy-ethyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2S)-2-[(2R)-4,5-dihydroxy-3-oxo-2-furanyl]-2-hydroxyethyl] ester IUPAC Name: [(2S)-2-[(2R)-4,5-dihydroxy-3-oxofuran-2-yl]-2-hydroxyethyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(2S)-2-[(2R)-4,5-dihydroxy-3-keto-2-furyl]-2-hydroxy-ethyl] ester Formula: C14H14O8 MolecularWeight: 310.25616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC(C2C(=O)C(=C(O2)O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OC[C@@H]([C@@H]2C(=O)C(=C(O2)O)O)O

InChI

InChI=1S/C14H14O8/c1-20-8-4-2-7(3-5-8)13(18)21-6-9(15)12-10(16)11(17)14(19)22-12/h2-5,9,12,15,17,19H,6H2,1H3/t9-,12+/m0/s1