2-(11-methyl-9-oxidanylidene-dodecyl)-3,4,5-tris(oxidanyl)benzoate

Systemtic Name: 2-(11-methyl-9-oxidanylidene-dodecyl)-3,4,5-tris(oxidanyl)benzoate Openeye Name: 3,4,5-trihydroxy-2-(11-methyl-9-oxo-dodecyl)benzoate CAS Name: 3,4,5-trihydroxy-2-(11-methyl-9-oxododecyl)benzoate IUPAC Name: 3,4,5-trihydroxy-2-(11-methyl-9-oxododecyl)benzoate Traditional Name: 3,4,5-trihydroxy-2-(9-keto-11-methyl-dodecyl)benzoate Formula: C20H29O6- MolecularWeight: 365.44066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CCCCCCCCC1=C(C(=C(C=C1C(=O)[O-])O)O)O

Isomeric SMILES

CC(C)CC(=O)CCCCCCCCC1=C(C(=C(C=C1C(=O)[O-])O)O)O

InChI

InChI=1S/C20H30O6/c1-13(2)11-14(21)9-7-5-3-4-6-8-10-15-16(20(25)26)12-17(22)19(24)18(15)23/h12-13,22-24H,3-11H2,1-2H3,(H,25,26)/p-1