2-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]-2-ethyl-butanoic acid

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]-2-ethyl-butanoic acid Openeye Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-ethyl-butanoic acid CAS Name: 2-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]-2-ethylbutanoic acid IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-ethylbutanoic acid Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-ethyl-butyric acid Formula: C14H16ClF3N2O3 MolecularWeight: 352.73665

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)O)NC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F

Isomeric SMILES

CCC(CC)(C(=O)O)NC(=O)NC1=CC(=C(C=C1)Cl)C(F)(F)F

InChI

InChI=1S/C14H16ClF3N2O3/c1-3-13(4-2,11(21)22)20-12(23)19-8-5-6-10(15)9(7-8)14(16,17)18/h5-7H,3-4H2,1-2H3,(H,21,22)(H2,19,20,23)