5-fluoranyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]benzoic acid

Systemtic Name: 5-fluoranyl-2-[2-(1,2,4-triazol-1-yl)ethanoylamino]benzoic acid Openeye Name: 5-fluoro-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]benzoic acid CAS Name: 5-fluoro-2-[[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]amino]benzoic acid IUPAC Name: 5-fluoro-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]benzoic acid Traditional Name: 5-fluoro-2-[[2-(1,2,4-triazol-1-yl)acetyl]amino]benzoic acid Formula: C11H9FN4O3 MolecularWeight: 264.212563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(=O)O)NC(=O)CN2C=NC=N2

Isomeric SMILES

C1=CC(=C(C=C1F)C(=O)O)NC(=O)CN2C=NC=N2

InChI

InChI=1S/C11H9FN4O3/c12-7-1-2-9(8(3-7)11(18)19)15-10(17)4-16-6-13-5-14-16/h1-3,5-6H,4H2,(H,15,17)(H,18,19)