2,2,4-tris(chloranyl)-4-cyano-butanoate

Systemtic Name: 2,2,4-tris(chloranyl)-4-cyano-butanoate Openeye Name: 2,2,4-trichloro-4-cyano-butanoate CAS Name: 2,2,4-trichloro-4-cyanobutanoate IUPAC Name: 2,2,4-trichloro-4-cyanobutanoate Traditional Name: 2,2,4-trichloro-4-cyano-butyrate Formula: C5H3Cl3NO2- MolecularWeight: 215.44182

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C#N)Cl)C(C(=O)[O-])(Cl)Cl

Isomeric SMILES

C(C(C#N)Cl)C(C(=O)[O-])(Cl)Cl

InChI

InChI=1S/C5H4Cl3NO2/c6-3(2-9)1-5(7,8)4(10)11/h3H,1H2,(H,10,11)/p-1