CHEBI:84013 - 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide

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ChEBI Name 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide ChEBI ID CHEBI:84013 ChEBI ASCII Name 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide Definition A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 2-cyano-3,3-dimethylbutanoic acid with the amino group of 1-(2,4-dichlorophenyl)ethylamine. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C15H18Cl2N2O Net Charge 0 Average Mass 313.22200 Monoisotopic Mass 312.07962 InChI InChI=1S/C15H18Cl2N2O/c1-9(11-6-5-10(16)7-13(11)17)19-14(20)12(8-18)15(2,3)4/h5-7,9,12H,1-4H3,(H,19,20) InChIKey YEJGPFZQLRMXOI-UHFFFAOYSA-N SMILES CC(NC(=O)C(C#N)C(C)(C)C)c1ccc(Cl)cc1Cl ChEBI Ontology Outgoing 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide (CHEBI:84013) is a dichlorobenzene (CHEBI:23697) 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide (CHEBI:84013) is a monocarboxylic acid amide (CHEBI:29347) 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide (CHEBI:84013) is a nitrile (CHEBI:18379) Incoming (1R,2R)-diclocymet (CHEBI:84015) is a 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide (CHEBI:84013) (1R,2S)-diclocymet (CHEBI:84014) is a 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide (CHEBI:84013) IUPAC Name 2-cyano-N-[1-(2,4-dichlorophenyl)ethyl]-3,3-dimethylbutanamide Last Modified 05 December 2014