4-[(3-fluorophenyl)methylamino]-2-methyl-pyrazole-3-carboxylate

Systemtic Name: 4-[(3-fluorophenyl)methylamino]-2-methyl-pyrazole-3-carboxylate Openeye Name: 4-[(3-fluorophenyl)methylamino]-2-methyl-pyrazole-3-carboxylate CAS Name: 4-[(3-fluorophenyl)methylamino]-2-methyl-3-pyrazolecarboxylate IUPAC Name: 4-[(3-fluorophenyl)methylamino]-2-methylpyrazole-3-carboxylate Traditional Name: 4-[(3-fluorobenzyl)amino]-2-methyl-pyrazole-3-carboxylate Formula: C12H11FN3O2- MolecularWeight: 248.233043

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NCC2=CC(=CC=C2)F)C(=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)NCC2=CC(=CC=C2)F)C(=O)[O-]

InChI

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