[2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: [2-(2-methoxyethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Openeye Name: [2-(2-methoxyethylcarbamoylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid [2-[[(2-methoxyethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylcarbamoylamino)-2-oxoethyl] 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(4-fluorophenyl)-1H-pyrazole-5-carboxylic acid [2-keto-2-(2-methoxyethylcarbamoylamino)ethyl] ester Formula: C16H17FN4O5 MolecularWeight: 364.328383

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)NC(=O)COC(=O)C1=CC(=NN1)C2=CC=C(C=C2)F

Isomeric SMILES

COCCNC(=O)NC(=O)COC(=O)C1=CC(=NN1)C2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN4O5/c1-25-7-6-18-16(24)19-14(22)9-26-15(23)13-8-12(20-21-13)10-2-4-11(17)5-3-10/h2-5,8H,6-7,9H2,1H3,(H,20,21)(H2,18,19,22,24)