bromanyl 2,2-dimethyl-4-oxidanylidene-pentanoate

Systemtic Name: bromanyl 2,2-dimethyl-4-oxidanylidene-pentanoate Openeye Name: bromo 2,2-dimethyl-4-oxo-pentanoate CAS Name: 2,2-dimethyl-4-oxopentanoic acid bromo ester IUPAC Name: bromo 2,2-dimethyl-4-oxopentanoate Traditional Name: 4-keto-2,2-dimethyl-valeric acid bromo ester Formula: C7H11BrO3 MolecularWeight: 223.06444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)C(=O)OBr

Isomeric SMILES

CC(=O)CC(C)(C)C(=O)OBr

InChI

InChI=1S/C7H11BrO3/c1-5(9)4-7(2,3)6(10)11-8/h4H2,1-3H3