3-methanoyl-4-(4-methyl-3-oxidanylidene-hexan-2-yl)-2,6-bis(oxidanyl)benzoic acid

Systemtic Name: 3-methanoyl-4-(4-methyl-3-oxidanylidene-hexan-2-yl)-2,6-bis(oxidanyl)benzoic acid Openeye Name: 4-(1,3-dimethyl-2-oxo-pentyl)-3-formyl-2,6-dihydroxy-benzoic acid CAS Name: 3-formyl-2,6-dihydroxy-4-(4-methyl-3-oxohexan-2-yl)benzoic acid IUPAC Name: 3-formyl-2,6-dihydroxy-4-(4-methyl-3-oxohexan-2-yl)benzoic acid Traditional Name: 3-formyl-2,6-dihydroxy-4-(2-keto-1,3-dimethyl-pentyl)benzoic acid Formula: C15H18O6 MolecularWeight: 294.29982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C(C)C1=CC(=C(C(=C1C=O)O)C(=O)O)O

Isomeric SMILES

CCC(C)C(=O)C(C)C1=CC(=C(C(=C1C=O)O)C(=O)O)O

InChI

InChI=1S/C15H18O6/c1-4-7(2)13(18)8(3)9-5-11(17)12(15(20)21)14(19)10(9)6-16/h5-8,17,19H,4H2,1-3H3,(H,20,21)