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4-(2,2-dimethyl-3-oxidanyl-3-oxidanylidene-propoxy)-2,6-dimethyl-benzenesulfinate

Systemtic Name:	4-(2,2-dimethyl-3-oxidanyl-3-oxidanylidene-propoxy)-2,6-dimethyl-benzenesulfinate
Openeye Name:	4-(3-hydroxy-2,2-dimethyl-3-oxo-propoxy)-2,6-dimethyl-benzenesulfinate
CAS Name:	4-(3-hydroxy-2,2-dimethyl-3-oxopropoxy)-2,6-dimethylbenzenesulfinate
IUPAC Name:	4-(3-hydroxy-2,2-dimethyl-3-oxopropoxy)-2,6-dimethylbenzenesulfinate
Traditional Name:	4-(3-hydroxy-3-keto-2,2-dimethyl-propoxy)-2,6-dimethyl-benzenesulfinate
Formula:	C₁₃H₁₇O₅S-
MolecularWeight:	285.33608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)[O-])C)OCC(C)(C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)[O-])C)OCC(C)(C)C(=O)O

InChI

InChI=1S/C13H18O5S/c1-8-5-10(6-9(2)11(8)19(16)17)18-7-13(3,4)12(14)15/h5-6H,7H2,1-4H3,(H,14,15)(H,16,17)/p-1

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