5-oxidanylidene-5-[[3-(trifluoromethyloxy)phenyl]amino]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[[3-(trifluoromethyloxy)phenyl]amino]pentanoic acid Openeye Name: 5-oxo-5-[3-(trifluoromethoxy)anilino]pentanoic acid CAS Name: 5-oxo-5-[3-(trifluoromethoxy)anilino]pentanoic acid IUPAC Name: 5-oxo-5-[3-(trifluoromethoxy)anilino]pentanoic acid Traditional Name: 5-keto-5-[3-(trifluoromethoxy)anilino]valeric acid Formula: C12H12F3NO4 MolecularWeight: 291.22319

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)(F)F)NC(=O)CCCC(=O)O

InChI

InChI=1S/C12H12F3NO4/c13-12(14,15)20-9-4-1-3-8(7-9)16-10(17)5-2-6-11(18)19/h1,3-4,7H,2,5-6H2,(H,16,17)(H,18,19)