4-(2-chloranyl-4-methylsulfonyl-phenyl)carbonyl-2-methyl-1H-pyrazol-3-one

Systemtic Name: 4-(2-chloranyl-4-methylsulfonyl-phenyl)carbonyl-2-methyl-1H-pyrazol-3-one Openeye Name: 4-(2-chloro-4-methylsulfonyl-benzoyl)-2-methyl-1H-pyrazol-3-one CAS Name: 4-[(2-chloro-4-methylsulfonylphenyl)-oxomethyl]-2-methyl-1H-pyrazol-3-one IUPAC Name: 4-(2-chloro-4-methylsulfonylbenzoyl)-2-methyl-1H-pyrazol-3-one Traditional Name: 4-(2-chloro-4-mesyl-benzoyl)-2-methyl-3-pyrazolin-3-one Formula: C12H11ClN2O4S MolecularWeight: 314.74474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CN1)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CN1C(=O)C(=CN1)C(=O)C2=C(C=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C12H11ClN2O4S/c1-15-12(17)9(6-14-15)11(16)8-4-3-7(5-10(8)13)20(2,18)19/h3-6,14H,1-2H3