4-(3-ethenyl-2-methoxy-4-methylsulfonyl-phenyl)carbonyl-2-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 4-(3-ethenyl-2-methoxy-4-methylsulfonyl-phenyl)carbonyl-2-propan-2-yl-1H-pyrazol-3-one Openeye Name: 2-isopropyl-4-(2-methoxy-4-methylsulfonyl-3-vinyl-benzoyl)-1H-pyrazol-3-one CAS Name: 4-[(3-ethenyl-2-methoxy-4-methylsulfonylphenyl)-oxomethyl]-2-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-(3-ethenyl-2-methoxy-4-methylsulfonylbenzoyl)-2-propan-2-yl-1H-pyrazol-3-one Traditional Name: 2-isopropyl-4-(4-mesyl-2-methoxy-3-vinyl-benzoyl)-3-pyrazolin-3-one Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C=C)OC

Isomeric SMILES

CC(C)N1C(=O)C(=CN1)C(=O)C2=C(C(=C(C=C2)S(=O)(=O)C)C=C)OC

InChI

InChI=1S/C17H20N2O5S/c1-6-11-14(25(5,22)23)8-7-12(16(11)24-4)15(20)13-9-18-19(10(2)3)17(13)21/h6-10,18H,1H2,2-5H3