5-fluoranyl-2-[3-[4-(5-oxidanylpyridin-2-yl)phenyl]propanoylamino]benzoic acid

Systemtic Name: 5-fluoranyl-2-[3-[4-(5-oxidanylpyridin-2-yl)phenyl]propanoylamino]benzoic acid Openeye Name: 5-fluoro-2-[3-[4-(5-hydroxy-2-pyridyl)phenyl]propanoylamino]benzoic acid CAS Name: 5-fluoro-2-[[3-[4-(5-hydroxy-2-pyridinyl)phenyl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 5-fluoro-2-[3-[4-(5-hydroxypyridin-2-yl)phenyl]propanoylamino]benzoic acid Traditional Name: 5-fluoro-2-[3-[4-(5-hydroxy-2-pyridyl)phenyl]propanoylamino]benzoic acid Formula: C21H17FN2O4 MolecularWeight: 380.369083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)NC2=C(C=C(C=C2)F)C(=O)O)C3=NC=C(C=C3)O

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)NC2=C(C=C(C=C2)F)C(=O)O)C3=NC=C(C=C3)O

InChI

InChI=1S/C21H17FN2O4/c22-15-6-8-19(17(11-15)21(27)28)24-20(26)10-3-13-1-4-14(5-2-13)18-9-7-16(25)12-23-18/h1-2,4-9,11-12,25H,3,10H2,(H,24,26)(H,27,28)