3-[(2-chloranyl-6-fluoranyl-phenyl)methylamino]-1H-pyrazole-5-carboxylate

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylamino]-1H-pyrazole-5-carboxylate Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylamino]-1H-pyrazole-5-carboxylate CAS Name: 3-[(2-chloro-6-fluorophenyl)methylamino]-1H-pyrazole-5-carboxylate IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylamino]-1H-pyrazole-5-carboxylate Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)amino]-1H-pyrazole-5-carboxylate Formula: C11H8ClFN3O2- MolecularWeight: 268.651523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CNC2=NNC(=C2)C(=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CNC2=NNC(=C2)C(=O)[O-])F

InChI

InChI=1S/C11H9ClFN3O2/c12-7-2-1-3-8(13)6(7)5-14-10-4-9(11(17)18)15-16-10/h1-4H,5H2,(H,17,18)(H2,14,15,16)/p-1