6-[3-(4,4-dimethyl-5-oxidanylidene-5-phenylmethoxy-pentyl)sulfinylpropylsulfinyl]-3,3-dimethyl-hexanoic acid

Systemtic Name: 6-[3-(4,4-dimethyl-5-oxidanylidene-5-phenylmethoxy-pentyl)sulfinylpropylsulfinyl]-3,3-dimethyl-hexanoic acid Openeye Name: 6-[3-(5-benzyloxy-4,4-dimethyl-5-oxo-pentyl)sulfinylpropylsulfinyl]-3,3-dimethyl-hexanoic acid CAS Name: 6-[3-(4,4-dimethyl-5-oxo-5-phenylmethoxypentyl)sulfinylpropylsulfinyl]-3,3-dimethylhexanoic acid IUPAC Name: 6-[3-(4,4-dimethyl-5-oxo-5-phenylmethoxypentyl)sulfinylpropylsulfinyl]-3,3-dimethylhexanoic acid Traditional Name: 6-[3-(5-benzoxy-5-keto-4,4-dimethyl-pentyl)sulfinylpropylsulfinyl]-3,3-dimethyl-hexanoic acid Formula: C25H40O6S2 MolecularWeight: 500.7115

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCS(=O)CCCS(=O)CCCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CC(C)(CCCS(=O)CCCS(=O)CCCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C25H40O6S2/c1-24(2,19-22(26)27)13-8-15-32(29)17-10-18-33(30)16-9-14-25(3,4)23(28)31-20-21-11-6-5-7-12-21/h5-7,11-12H,8-10,13-20H2,1-4H3,(H,26,27)