3-(4-bromanyl-3,5-dimethyl-phenoxy)-2,2-dimethyl-propanoate

Systemtic Name: 3-(4-bromanyl-3,5-dimethyl-phenoxy)-2,2-dimethyl-propanoate Openeye Name: 3-(4-bromo-3,5-dimethyl-phenoxy)-2,2-dimethyl-propanoate CAS Name: 3-(4-bromo-3,5-dimethylphenoxy)-2,2-dimethylpropanoate IUPAC Name: 3-(4-bromo-3,5-dimethylphenoxy)-2,2-dimethylpropanoate Traditional Name: 3-(4-bromo-3,5-dimethyl-phenoxy)-2,2-dimethyl-propionate Formula: C13H16BrO3- MolecularWeight: 300.16834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OCC(C)(C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)OCC(C)(C)C(=O)[O-]

InChI

InChI=1S/C13H17BrO3/c1-8-5-10(6-9(2)11(8)14)17-7-13(3,4)12(15)16/h5-6H,7H2,1-4H3,(H,15,16)/p-1