(1S,2R,3S)-3-(furan-2-yl)-5-oxidanylidene-cyclohexane-1,2-dicarboxylic acid

Systemtic Name: (1S,2R,3S)-3-(furan-2-yl)-5-oxidanylidene-cyclohexane-1,2-dicarboxylic acid Openeye Name: (1S,2R,3S)-3-(2-furyl)-5-oxo-cyclohexane-1,2-dicarboxylic acid CAS Name: (1S,2R,3S)-3-(2-furanyl)-5-oxocyclohexane-1,2-dicarboxylic acid IUPAC Name: (1S,2R,3S)-3-(furan-2-yl)-5-oxocyclohexane-1,2-dicarboxylic acid Traditional Name: (1S,2R,3S)-3-(2-furyl)-5-keto-cyclohexane-1,2-dicarboxylic acid Formula: C12H12O6 MolecularWeight: 252.22008

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(CC1=O)C(=O)O)C(=O)O)C2=CC=CO2

Isomeric SMILES

C1[C@@H]([C@H]([C@H](CC1=O)C(=O)O)C(=O)O)C2=CC=CO2

InChI

InChI=1S/C12H12O6/c13-6-4-7(9-2-1-3-18-9)10(12(16)17)8(5-6)11(14)15/h1-3,7-8,10H,4-5H2,(H,14,15)(H,16,17)/t7-,8+,10-/m1/s1