4-bromanyl-4-(4-chloranyl-3,5-dimethyl-phenoxy)-2,2-dimethyl-3-oxidanylidene-butanoic acid

Systemtic Name: 4-bromanyl-4-(4-chloranyl-3,5-dimethyl-phenoxy)-2,2-dimethyl-3-oxidanylidene-butanoic acid Openeye Name: 4-bromo-4-(4-chloro-3,5-dimethyl-phenoxy)-2,2-dimethyl-3-oxo-butanoic acid CAS Name: 4-bromo-4-(4-chloro-3,5-dimethylphenoxy)-2,2-dimethyl-3-oxobutanoic acid IUPAC Name: 4-bromo-4-(4-chloro-3,5-dimethylphenoxy)-2,2-dimethyl-3-oxobutanoic acid Traditional Name: 4-bromo-4-(4-chloro-3,5-dimethyl-phenoxy)-3-keto-2,2-dimethyl-butyric acid Formula: C14H16BrClO4 MolecularWeight: 363.63144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(C(=O)C(C)(C)C(=O)O)Br

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(C(=O)C(C)(C)C(=O)O)Br

InChI

InChI=1S/C14H16BrClO4/c1-7-5-9(6-8(2)10(7)16)20-12(15)11(17)14(3,4)13(18)19/h5-6,12H,1-4H3,(H,18,19)