3-bromanyl-2,2-dimethyl-4-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: 3-bromanyl-2,2-dimethyl-4-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 3-bromo-2,2-dimethyl-4-oxo-4-phenyl-butanoic acid CAS Name: 3-bromo-2,2-dimethyl-4-oxo-4-phenylbutanoic acid IUPAC Name: 3-bromo-2,2-dimethyl-4-oxo-4-phenylbutanoic acid Traditional Name: 3-bromo-4-keto-2,2-dimethyl-4-phenyl-butyric acid Formula: C12H13BrO3 MolecularWeight: 285.13382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)C1=CC=CC=C1)Br)C(=O)O

Isomeric SMILES

CC(C)(C(C(=O)C1=CC=CC=C1)Br)C(=O)O

InChI

InChI=1S/C12H13BrO3/c1-12(2,11(15)16)10(13)9(14)8-6-4-3-5-7-8/h3-7,10H,1-2H3,(H,15,16)