2-[2-methyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfonyl-phenyl]carbonyl-5-[(2-methylpropan-2-yl)oxymethyl]cyclohexane-1,3-dione

Systemtic Name: 2-[2-methyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfonyl-phenyl]carbonyl-5-[(2-methylpropan-2-yl)oxymethyl]cyclohexane-1,3-dione Openeye Name: 5-(tert-butoxymethyl)-2-[2-methyl-3-(3-methylisoxazol-5-yl)-4-methylsulfonyl-benzoyl]cyclohexane-1,3-dione CAS Name: 2-[[2-methyl-3-(3-methyl-5-isoxazolyl)-4-methylsulfonylphenyl]-oxomethyl]-5-[(2-methylpropan-2-yl)oxymethyl]cyclohexane-1,3-dione IUPAC Name: 2-[2-methyl-3-(3-methyl-1,2-oxazol-5-yl)-4-methylsulfonylbenzoyl]-5-[(2-methylpropan-2-yl)oxymethyl]cyclohexane-1,3-dione Traditional Name: 5-(tert-butoxymethyl)-2-[4-mesyl-2-methyl-3-(3-methylisoxazol-5-yl)benzoyl]cyclohexane-1,3-quinone Formula: C24H29NO7S MolecularWeight: 475.55456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=C(C=CC(=C2C)C(=O)C3C(=O)CC(CC3=O)COC(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=NOC(=C1)C2=C(C=CC(=C2C)C(=O)C3C(=O)CC(CC3=O)COC(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C24H29NO7S/c1-13-9-19(32-25-13)21-14(2)16(7-8-20(21)33(6,29)30)23(28)22-17(26)10-15(11-18(22)27)12-31-24(3,4)5/h7-9,15,22H,10-12H2,1-6H3