2-(4-bromanyl-2,3,6-trimethyl-phenoxy)-2-methyl-propanoic acid

Systemtic Name: 2-(4-bromanyl-2,3,6-trimethyl-phenoxy)-2-methyl-propanoic acid Openeye Name: 2-(4-bromo-2,3,6-trimethyl-phenoxy)-2-methyl-propanoic acid CAS Name: 2-(4-bromo-2,3,6-trimethylphenoxy)-2-methylpropanoic acid IUPAC Name: 2-(4-bromo-2,3,6-trimethylphenoxy)-2-methylpropanoic acid Traditional Name: 2-(4-bromo-2,3,6-trimethyl-phenoxy)-2-methyl-propionic acid Formula: C13H17BrO3 MolecularWeight: 301.17628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC(C)(C)C(=O)O)C)C)Br

Isomeric SMILES

CC1=CC(=C(C(=C1OC(C)(C)C(=O)O)C)C)Br

InChI

InChI=1S/C13H17BrO3/c1-7-6-10(14)8(2)9(3)11(7)17-13(4,5)12(15)16/h6H,1-5H3,(H,15,16)