[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 3-phenyl-1H-pyrazole-5-carboxylate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 3-phenyl-1H-pyrazole-5-carboxylate CAS Name: 3-phenyl-1H-pyrazole-5-carboxylic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 3-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 3-phenyl-1H-pyrazole-5-carboxylic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C18H14FN3O3 MolecularWeight: 339.320463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C18H14FN3O3/c19-13-7-4-8-14(9-13)20-17(23)11-25-18(24)16-10-15(21-22-16)12-5-2-1-3-6-12/h1-10H,11H2,(H,20,23)(H,21,22)