[2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1,3,5-trimethylpyrazole-4-carboxylate

Systemtic Name: [2-[(5-fluoranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1,3,5-trimethylpyrazole-4-carboxylate Openeye Name: [2-(5-fluoro-2-methyl-anilino)-2-oxo-ethyl] 1,3,5-trimethylpyrazole-4-carboxylate CAS Name: 1,3,5-trimethyl-4-pyrazolecarboxylic acid [2-(5-fluoro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-fluoro-2-methylanilino)-2-oxoethyl] 1,3,5-trimethylpyrazole-4-carboxylate Traditional Name: 1,3,5-trimethylpyrazole-4-carboxylic acid [2-(5-fluoro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C16H18FN3O3 MolecularWeight: 319.330823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)COC(=O)C2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)COC(=O)C2=C(N(N=C2C)C)C

InChI

InChI=1S/C16H18FN3O3/c1-9-5-6-12(17)7-13(9)18-14(21)8-23-16(22)15-10(2)19-20(4)11(15)3/h5-7H,8H2,1-4H3,(H,18,21)