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2-[(4-ethynyl-2-fluoranyl-phenyl)amino]-3,4-bis(fluoranyl)benzoic acid

2-[(4-ethynyl-2-fluoranyl-phenyl)amino]-3,4-bis(fluoranyl)benzoic acid

Systemtic Name:2-[(4-ethynyl-2-fluoranyl-phenyl)amino]-3,4-bis(fluoranyl)benzoic acid
Openeye Name:2-(4-ethynyl-2-fluoro-anilino)-3,4-difluoro-benzoic acid
CAS Name:2-(4-ethynyl-2-fluoroanilino)-3,4-difluorobenzoic acid
IUPAC Name:2-(4-ethynyl-2-fluoroanilino)-3,4-difluorobenzoic acid
Traditional Name:2-(4-ethynyl-2-fluoro-anilino)-3,4-difluoro-benzoic acid
Formula: C15H8F3NO2
MolecularWeight: 291.22473
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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=C(C=C1)NC2=C(C=CC(=C2F)F)C(=O)O)F


Isomeric SMILES

C#CC1=CC(=C(C=C1)NC2=C(C=CC(=C2F)F)C(=O)O)F


InChI

InChI=1S/C15H8F3NO2/c1-2-8-3-6-12(11(17)7-8)19-14-9(15(20)21)4-5-10(16)13(14)18/h1,3-7,19H,(H,20,21)


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