[5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenyl-pyrazol-3-yl] 2,6-bis(fluoranyl)benzoate

Systemtic Name: [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenyl-pyrazol-3-yl] 2,6-bis(fluoranyl)benzoate Openeye Name: [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenyl-pyrazol-3-yl] 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenyl-3-pyrazolyl] ester IUPAC Name: [5-methyl-4-(4-nitrophenyl)sulfonyl-2-phenylpyrazol-3-yl] 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid (5-methyl-4-nosyl-2-phenyl-pyrazol-3-yl) ester Formula: C23H15F2N3O6S MolecularWeight: 499.443506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=C(C=CC=C3F)F)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=C(C=CC=C3F)F)C4=CC=CC=C4

InChI

InChI=1S/C23H15F2N3O6S/c1-14-21(35(32,33)17-12-10-16(11-13-17)28(30)31)22(27(26-14)15-6-3-2-4-7-15)34-23(29)20-18(24)8-5-9-19(20)25/h2-13H,1H3