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

Systemtic Name: 4-(2-chloranyl-3-methyl-4-methylsulfonyl-phenyl)carbonyl-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-(2-chloro-3-methyl-4-methylsulfonyl-benzoyl)-2-isopropyl-1H-pyrazol-3-one CAS Name: 4-[(2-chloro-3-methyl-4-methylsulfonylphenyl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(2-chloro-3-methyl-4-methylsulfonylbenzoyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-(2-chloro-4-mesyl-3-methyl-benzoyl)-2-isopropyl-3-pyrazolin-3-one Formula: C15H17ClN2O4S MolecularWeight: 356.82448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)C(=O)C2=CNN(C2=O)C(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1Cl)C(=O)C2=CNN(C2=O)C(C)C)S(=O)(=O)C

InChI

InChI=1S/C15H17ClN2O4S/c1-8(2)18-15(20)11(7-17-18)14(19)10-5-6-12(23(4,21)22)9(3)13(10)16/h5-8,17H,1-4H3