2-acetamido-3-[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]propanoic acid

Systemtic Name: 2-acetamido-3-[3,5-bis(fluoranyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-acetamido-3-(3,5-difluoro-4-hydroxy-phenyl)propanoic acid CAS Name: 2-acetamido-3-(3,5-difluoro-4-hydroxyphenyl)propanoic acid IUPAC Name: 2-acetamido-3-(3,5-difluoro-4-hydroxyphenyl)propanoic acid Traditional Name: 2-acetamido-3-(3,5-difluoro-4-hydroxy-phenyl)propionic acid Formula: C11H11F2NO4 MolecularWeight: 259.206146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C(=C1)F)O)F)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC(=C(C(=C1)F)O)F)C(=O)O

InChI

InChI=1S/C11H11F2NO4/c1-5(15)14-9(11(17)18)4-6-2-7(12)10(16)8(13)3-6/h2-3,9,16H,4H2,1H3,(H,14,15)(H,17,18)