2,4-bis(fluoranyl)-5-[(1-methylpyrazol-4-yl)methylamino]benzoic acid

Systemtic Name: 2,4-bis(fluoranyl)-5-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Openeye Name: 2,4-difluoro-5-[(1-methylpyrazol-4-yl)methylamino]benzoic acid CAS Name: 2,4-difluoro-5-[(1-methyl-4-pyrazolyl)methylamino]benzoic acid IUPAC Name: 2,4-difluoro-5-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Traditional Name: 2,4-difluoro-5-[(1-methylpyrazol-4-yl)methylamino]benzoic acid Formula: C12H11F2N3O2 MolecularWeight: 267.231446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11F2N3O2/c1-17-6-7(5-16-17)4-15-11-2-8(12(18)19)9(13)3-10(11)14/h2-3,5-6,15H,4H2,1H3,(H,18,19)