5-[3-(3,3-dimethyl-4-oxidanylidene-4-phenoxy-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-pentanoic acid

Systemtic Name: 5-[3-(3,3-dimethyl-4-oxidanylidene-4-phenoxy-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-pentanoic acid Openeye Name: 5-[3-(3,3-dimethyl-4-oxo-4-phenoxy-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-pentanoic acid CAS Name: 5-[3-(3,3-dimethyl-4-oxo-4-phenoxybutyl)sulfinylpropylsulfinyl]-3,3-dimethylpentanoic acid IUPAC Name: 5-[3-(3,3-dimethyl-4-oxo-4-phenoxybutyl)sulfinylpropylsulfinyl]-3,3-dimethylpentanoic acid Traditional Name: 5-[3-(4-keto-3,3-dimethyl-4-phenoxy-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-valeric acid Formula: C22H34O6S2 MolecularWeight: 458.63176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCS(=O)CCCS(=O)CCC(C)(C)C(=O)OC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CC(C)(CCS(=O)CCCS(=O)CCC(C)(C)C(=O)OC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C22H34O6S2/c1-21(2,17-19(23)24)11-15-29(26)13-8-14-30(27)16-12-22(3,4)20(25)28-18-9-6-5-7-10-18/h5-7,9-10H,8,11-17H2,1-4H3,(H,23,24)