4-[2-acetamido-4,5-bis(fluoranyl)phenyl]butanoic acid

Systemtic Name: 4-[2-acetamido-4,5-bis(fluoranyl)phenyl]butanoic acid Openeye Name: 4-(2-acetamido-4,5-difluoro-phenyl)butanoic acid CAS Name: 4-(2-acetamido-4,5-difluorophenyl)butanoic acid IUPAC Name: 4-(2-acetamido-4,5-difluorophenyl)butanoic acid Traditional Name: 4-(2-acetamido-4,5-difluoro-phenyl)butyric acid Formula: C12H13F2NO3 MolecularWeight: 257.233326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1CCCC(=O)O)F)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1CCCC(=O)O)F)F

InChI

InChI=1S/C12H13F2NO3/c1-7(16)15-11-6-10(14)9(13)5-8(11)3-2-4-12(17)18/h5-6H,2-4H2,1H3,(H,15,16)(H,17,18)