propan-2-yl 2-chloranyl-3-[(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)carbonyl]-6-methylsulfonyl-benzoate

Systemtic Name: propan-2-yl 2-chloranyl-3-[(2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)carbonyl]-6-methylsulfonyl-benzoate Openeye Name: isopropyl 2-chloro-3-(2-methyl-3-oxo-1H-pyrazole-4-carbonyl)-6-methylsulfonyl-benzoate CAS Name: 2-chloro-3-[(2-methyl-3-oxo-1H-pyrazol-4-yl)-oxomethyl]-6-methylsulfonylbenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-3-(2-methyl-3-oxo-1H-pyrazole-4-carbonyl)-6-methylsulfonylbenzoate Traditional Name: 2-chloro-3-(5-keto-1-methyl-3-pyrazoline-4-carbonyl)-6-mesyl-benzoic acid isopropyl ester Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=CC(=C1Cl)C(=O)C2=CNN(C2=O)C)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=C(C=CC(=C1Cl)C(=O)C2=CNN(C2=O)C)S(=O)(=O)C

InChI

InChI=1S/C16H17ClN2O6S/c1-8(2)25-16(22)12-11(26(4,23)24)6-5-9(13(12)17)14(20)10-7-18-19(3)15(10)21/h5-8,18H,1-4H3