2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]-1,5-dimethyl-pyrazol-3-one

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfonyl]phenyl]-1,5-dimethyl-pyrazol-3-one Openeye Name: 2-[4-(difluoromethylsulfonyl)phenyl]-1,5-dimethyl-pyrazol-3-one CAS Name: 2-[4-(difluoromethylsulfonyl)phenyl]-1,5-dimethyl-3-pyrazolone IUPAC Name: 2-[4-(difluoromethylsulfonyl)phenyl]-1,5-dimethylpyrazol-3-one Traditional Name: 2-[4-(difluoromethylsulfonyl)phenyl]-1,5-dimethyl-3-pyrazolin-3-one Formula: C12H12F2N2O3S MolecularWeight: 302.297086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)C(F)F

Isomeric SMILES

CC1=CC(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)C(F)F

InChI

InChI=1S/C12H12F2N2O3S/c1-8-7-11(17)16(15(8)2)9-3-5-10(6-4-9)20(18,19)12(13)14/h3-7,12H,1-2H3