CHEBI:84020 - (S,R)-fenoxanil

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ChEBI Name (S,R)-fenoxanil ChEBI ID CHEBI:84020 ChEBI ASCII Name (S,R)-fenoxanil Definition The stereoisomer of N-(2-cyano-3-methylbutan-2-yl)-2-(2,4-dichlorophenoxy)propanamide obtained by formal condensation of the carboxy group of (S)-2-(2,4-dichlorophenoxy)propanoic acid with the amino group of (R)-2-amino-2,3-dimethylbutanenitrile. 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 C15H18Cl2N2O2 Net Charge 0 Average Mass 329.22200 Monoisotopic Mass 328.07453 InChI InChI=1S/C15H18Cl2N2O2/c1-9(2)15(4,8-18)19-14(20)10(3)21-13-6-5-11(16)7-12(13)17/h5-7,9-10H,1-4H3,(H,19,20)/t10-,15-/m0/s1 InChIKey IUOKJNROJISWRO-BONVTDFDSA-N SMILES CC(C)[C@@](C)(NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)C#N ChEBI Ontology Outgoing (S,R)-fenoxanil (CHEBI:84020) is a N-(2-cyano-3-methylbutan-2-yl)-2-(2,4-dichlorophenoxy)propanamide (CHEBI:84016) (S,R)-fenoxanil (CHEBI:84020) is enantiomer of (R,S)-fenoxanil (CHEBI:84018) Incoming fenoxanil (CHEBI:81800) has part (S,R)-fenoxanil (CHEBI:84020) (R,S)-fenoxanil (CHEBI:84018) is enantiomer of (S,R)-fenoxanil (CHEBI:84020) IUPAC Name (2S)-N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-(2,4-dichlorophenoxy)propanamide Last Modified 05 December 2014