methyl 5-bromanyl-2-ethyl-4-oxidanylidene-pentanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13BrO3/c1-3-6(8(11)12-2)4-7(10)5-9/h6H,3-5H2,1-2H3