[2,4,6-tris(chloranyl)phenyl] 4,4-dimethyl-3-oxidanylidene-pentane-1-sulfonate

Systemtic Name: [2,4,6-tris(chloranyl)phenyl] 4,4-dimethyl-3-oxidanylidene-pentane-1-sulfonate Openeye Name: (2,4,6-trichlorophenyl) 4,4-dimethyl-3-oxo-pentane-1-sulfonate CAS Name: 4,4-dimethyl-3-oxo-1-pentanesulfonic acid IUPAC Name: (2,4,6-trichlorophenyl) 4,4-dimethyl-3-oxopentane-1-sulfonate Traditional Name: 3-keto-4,4-dimethyl-pentane-1-sulfonic acid (2,4,6-trichlorophenyl) ester Formula: C13H15Cl3O4S MolecularWeight: 373.6798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CCS(=O)(=O)OC1=C(C=C(C=C1Cl)Cl)Cl

Isomeric SMILES

CC(C)(C)C(=O)CCS(=O)(=O)OC1=C(C=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C13H15Cl3O4S/c1-13(2,3)11(17)4-5-21(18,19)20-12-9(15)6-8(14)7-10(12)16/h6-7H,4-5H2,1-3H3