[1-oxidanylidene-1-(propylamino)propan-2-yl] 5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)F)Cl

InChI

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