methyl 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]amino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]amino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetyl]amino]-4-fluoro-benzoate CAS Name: 3-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1,2-dioxoethyl]amino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetyl]amino]-4-fluorobenzoate Traditional Name: 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetyl]amino]-4-fluoro-benzoic acid methyl ester Formula: C21H18FN3O4 MolecularWeight: 395.383723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F

InChI

InChI=1S/C21H18FN3O4/c1-12-18(13(2)25(24-12)15-7-5-4-6-8-15)19(26)20(27)23-17-11-14(21(28)29-3)9-10-16(17)22/h4-11H,1-3H3,(H,23,27)