4-[3-(3,3-dimethyl-4-oxidanylidene-4-phenylmethoxy-butyl)sulfanylpropylsulfanyl]-2,2-dimethyl-butanoic acid

Systemtic Name: 4-[3-(3,3-dimethyl-4-oxidanylidene-4-phenylmethoxy-butyl)sulfanylpropylsulfanyl]-2,2-dimethyl-butanoic acid Openeye Name: 4-[3-(4-benzyloxy-3,3-dimethyl-4-oxo-butyl)sulfanylpropylsulfanyl]-2,2-dimethyl-butanoic acid CAS Name: 4-[3-[(3,3-dimethyl-4-oxo-4-phenylmethoxybutyl)thio]propylthio]-2,2-dimethylbutanoic acid IUPAC Name: 4-[3-(3,3-dimethyl-4-oxo-4-phenylmethoxybutyl)sulfanylpropylsulfanyl]-2,2-dimethylbutanoic acid Traditional Name: 4-[3-[(4-benzoxy-4-keto-3,3-dimethyl-butyl)thio]propylthio]-2,2-dimethyl-butyric acid Formula: C22H34O4S2 MolecularWeight: 426.63296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCSCCCSCCC(C)(C)C(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(C)(CCSCCCSCCC(C)(C)C(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C22H34O4S2/c1-21(2,19(23)24)11-15-27-13-8-14-28-16-12-22(3,4)20(25)26-17-18-9-6-5-7-10-18/h5-7,9-10H,8,11-17H2,1-4H3,(H,23,24)