2-bromanyl-3-cyano-3-methyl-pentanoate

Systemtic Name: 2-bromanyl-3-cyano-3-methyl-pentanoate Openeye Name: 2-bromo-3-cyano-3-methyl-pentanoate CAS Name: 2-bromo-3-cyano-3-methylpentanoate IUPAC Name: 2-bromo-3-cyano-3-methylpentanoate Traditional Name: 2-bromo-3-cyano-3-methyl-valerate Formula: C7H9BrNO2- MolecularWeight: 219.05586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#N)C(C(=O)[O-])Br

Isomeric SMILES

CCC(C)(C#N)C(C(=O)[O-])Br

InChI

InChI=1S/C7H10BrNO2/c1-3-7(2,4-9)5(8)6(10)11/h5H,3H2,1-2H3,(H,10,11)/p-1