2-(2,2-dimethylpropanoyloxy)-6-methyl-benzoic acid

Systemtic Name: 2-(2,2-dimethylpropanoyloxy)-6-methyl-benzoic acid Openeye Name: 2-(2,2-dimethylpropanoyloxy)-6-methyl-benzoic acid CAS Name: 2-(2,2-dimethyl-1-oxopropoxy)-6-methylbenzoic acid IUPAC Name: 2-(2,2-dimethylpropanoyloxy)-6-methylbenzoic acid Traditional Name: 2-methyl-6-pivaloyloxy-benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(=O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)OC(=O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C13H16O4/c1-8-6-5-7-9(10(8)11(14)15)17-12(16)13(2,3)4/h5-7H,1-4H3,(H,14,15)