2-fluoranyl-5-[(2-methylpyrazol-3-yl)methylamino]benzoic acid

Systemtic Name: 2-fluoranyl-5-[(2-methylpyrazol-3-yl)methylamino]benzoic acid Openeye Name: 2-fluoro-5-[(2-methylpyrazol-3-yl)methylamino]benzoic acid CAS Name: 2-fluoro-5-[(2-methyl-3-pyrazolyl)methylamino]benzoic acid IUPAC Name: 2-fluoro-5-[(2-methylpyrazol-3-yl)methylamino]benzoic acid Traditional Name: 2-fluoro-5-[(2-methylpyrazol-3-yl)methylamino]benzoic acid Formula: C12H12FN3O2 MolecularWeight: 249.240983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)CNC2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CN1C(=CC=N1)CNC2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C12H12FN3O2/c1-16-9(4-5-15-16)7-14-8-2-3-11(13)10(6-8)12(17)18/h2-6,14H,7H2,1H3,(H,17,18)