4-[(2-chloranyl-6-fluoranyl-phenyl)methylamino]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methylamino]-2-methyl-pyrazole-3-carboxylate Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methylamino]-2-methyl-pyrazole-3-carboxylate CAS Name: 4-[(2-chloro-6-fluorophenyl)methylamino]-2-methyl-3-pyrazolecarboxylate IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methylamino]-2-methylpyrazole-3-carboxylate Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)amino]-2-methyl-pyrazole-3-carboxylate Formula: C12H10ClFN3O2- MolecularWeight: 282.678103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NCC2=C(C=CC=C2Cl)F)C(=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)NCC2=C(C=CC=C2Cl)F)C(=O)[O-]

InChI

InChI=1S/C12H11ClFN3O2/c1-17-11(12(18)19)10(6-16-17)15-5-7-8(13)3-2-4-9(7)14/h2-4,6,15H,5H2,1H3,(H,18,19)/p-1