methyl 5-bromanyl-2,2-dimethyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-bromanyl-2,2-dimethyl-4-oxidanylidene-pentanoate Openeye Name: methyl 5-bromo-2,2-dimethyl-4-oxo-pentanoate CAS Name: 5-bromo-2,2-dimethyl-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-bromo-2,2-dimethyl-4-oxopentanoate Traditional Name: 5-bromo-4-keto-2,2-dimethyl-valeric acid methyl ester Formula: C8H13BrO3 MolecularWeight: 237.09102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)CBr)C(=O)OC

Isomeric SMILES

CC(C)(CC(=O)CBr)C(=O)OC

InChI

InChI=1S/C8H13BrO3/c1-8(2,7(11)12-3)4-6(10)5-9/h4-5H2,1-3H3