3,3-bis(chloranyl)-4-cyano-butanoic acid

Systemtic Name: 3,3-bis(chloranyl)-4-cyano-butanoic acid Openeye Name: 3,3-dichloro-4-cyano-butanoic acid CAS Name: 3,3-dichloro-4-cyanobutanoic acid IUPAC Name: 3,3-dichloro-4-cyanobutanoic acid Traditional Name: 3,3-dichloro-4-cyano-butyric acid Formula: C5H5Cl2NO2 MolecularWeight: 182.0047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H5Cl2NO2/c6-5(7,1-2-8)3-4(9)10/h1,3H2,(H,9,10)