[2-(butylamino)-2-oxidanylidene-ethyl] 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxylate Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C17H19ClFN3O3 MolecularWeight: 367.802463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C17H19ClFN3O3/c1-3-4-9-20-14(23)10-25-17(24)15-11(2)21-22(16(15)18)13-7-5-12(19)6-8-13/h5-8H,3-4,9-10H2,1-2H3,(H,20,23)