methyl 5-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylamino]-2,4-bis(fluoranyl)benzoate

Systemtic Name: methyl 5-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylamino]-2,4-bis(fluoranyl)benzoate Openeye Name: methyl 5-[(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)amino]-2,4-difluoro-benzoate CAS Name: 5-[[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]amino]-2,4-difluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)amino]-2,4-difluorobenzoate Traditional Name: 5-[(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)amino]-2,4-difluoro-benzoic acid methyl ester Formula: C21H17F2N3O3 MolecularWeight: 397.374786

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H17F2N3O3/c1-29-21(28)14-9-18(16(23)10-15(14)22)24-20(27)19-11-17(12-7-8-12)25-26(19)13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3,(H,24,27)