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

Systemtic Name: 5-[3-(3,3-dimethyl-4-oxidanylidene-4-phenylmethoxy-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-pentanoic acid Openeye Name: 5-[3-(4-benzyloxy-3,3-dimethyl-4-oxo-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-pentanoic acid CAS Name: 5-[3-(3,3-dimethyl-4-oxo-4-phenylmethoxybutyl)sulfinylpropylsulfinyl]-3,3-dimethylpentanoic acid IUPAC Name: 5-[3-(3,3-dimethyl-4-oxo-4-phenylmethoxybutyl)sulfinylpropylsulfinyl]-3,3-dimethylpentanoic acid Traditional Name: 5-[3-(4-benzoxy-4-keto-3,3-dimethyl-butyl)sulfinylpropylsulfinyl]-3,3-dimethyl-valeric acid Formula: C23H36O6S2 MolecularWeight: 472.65834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCS(=O)CCCS(=O)CCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CC(C)(CCS(=O)CCCS(=O)CCC(C)(C)C(=O)OCC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C23H36O6S2/c1-22(2,17-20(24)25)11-15-30(27)13-8-14-31(28)16-12-23(3,4)21(26)29-18-19-9-6-5-7-10-19/h5-7,9-10H,8,11-18H2,1-4H3,(H,24,25)