5-bromanyl-2-ethanoyl-2-ethyl-pentanoate

Systemtic Name: 5-bromanyl-2-ethanoyl-2-ethyl-pentanoate Openeye Name: 2-acetyl-5-bromo-2-ethyl-pentanoate CAS Name: 2-acetyl-5-bromo-2-ethylpentanoate IUPAC Name: 2-acetyl-5-bromo-2-ethylpentanoate Traditional Name: 2-acetyl-5-bromo-2-ethyl-valerate Formula: C9H14BrO3- MolecularWeight: 250.10966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCBr)(C(=O)C)C(=O)[O-]

Isomeric SMILES

CCC(CCCBr)(C(=O)C)C(=O)[O-]

InChI

InChI=1S/C9H15BrO3/c1-3-9(7(2)11,8(12)13)5-4-6-10/h3-6H2,1-2H3,(H,12,13)/p-1