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

Systemtic Name: ethyl 2,2,4-tris(chloranyl)-4-cyano-butanoate Openeye Name: ethyl 2,2,4-trichloro-4-cyano-butanoate CAS Name: 2,2,4-trichloro-4-cyanobutanoic acid ethyl ester IUPAC Name: ethyl 2,2,4-trichloro-4-cyanobutanoate Traditional Name: 2,2,4-trichloro-4-cyano-butyric acid ethyl ester Formula: C7H8Cl3NO2 MolecularWeight: 244.50292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C#N)Cl)(Cl)Cl

Isomeric SMILES

CCOC(=O)C(CC(C#N)Cl)(Cl)Cl

InChI

InChI=1S/C7H8Cl3NO2/c1-2-13-6(12)7(9,10)3-5(8)4-11/h5H,2-3H2,1H3