3-(2,6-dimethylphenoxy)-2,2-dimethyl-propanoic acid

Systemtic Name: 3-(2,6-dimethylphenoxy)-2,2-dimethyl-propanoic acid Openeye Name: 3-(2,6-dimethylphenoxy)-2,2-dimethyl-propanoic acid CAS Name: 3-(2,6-dimethylphenoxy)-2,2-dimethylpropanoic acid IUPAC Name: 3-(2,6-dimethylphenoxy)-2,2-dimethylpropanoic acid Traditional Name: 3-(2,6-dimethylphenoxy)-2,2-dimethyl-propionic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O3/c1-9-6-5-7-10(2)11(9)16-8-13(3,4)12(14)15/h5-7H,8H2,1-4H3,(H,14,15)