2-[[3,4-bis(fluoranyl)phenyl]-(2-ethylbutanoyl)amino]ethanoate

Systemtic Name: 2-[[3,4-bis(fluoranyl)phenyl]-(2-ethylbutanoyl)amino]ethanoate Openeye Name: 2-[N-(2-ethylbutanoyl)-3,4-difluoro-anilino]acetate CAS Name: 2-(N-(2-ethyl-1-oxobutyl)-3,4-difluoroanilino)acetate IUPAC Name: 2-[N-(2-ethylbutanoyl)-3,4-difluoroanilino]acetate Traditional Name: 2-[N-(2-ethylbutanoyl)-3,4-difluoro-anilino]acetate Formula: C14H16F2NO3- MolecularWeight: 284.278546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC(=O)[O-])C1=CC(=C(C=C1)F)F

Isomeric SMILES

CCC(CC)C(=O)N(CC(=O)[O-])C1=CC(=C(C=C1)F)F

InChI

InChI=1S/C14H17F2NO3/c1-3-9(4-2)14(20)17(8-13(18)19)10-5-6-11(15)12(16)7-10/h5-7,9H,3-4,8H2,1-2H3,(H,18,19)/p-1