4-[2-(3-methyl-4-oxidanyl-phenyl)sulfanylethanoyloxy]butyl 2-(3-methyl-4-oxidanyl-phenyl)sulfanylethanoate

Systemtic Name: 4-[2-(3-methyl-4-oxidanyl-phenyl)sulfanylethanoyloxy]butyl 2-(3-methyl-4-oxidanyl-phenyl)sulfanylethanoate Openeye Name: 4-[2-(4-hydroxy-3-methyl-phenyl)sulfanylacetyl]oxybutyl 2-(4-hydroxy-3-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-hydroxy-3-methylphenyl)thio]acetic acid 4-[2-[(4-hydroxy-3-methylphenyl)thio]-1-oxoethoxy]butyl ester IUPAC Name: 4-[2-(4-hydroxy-3-methylphenyl)sulfanylacetyl]oxybutyl 2-(4-hydroxy-3-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-hydroxy-3-methyl-phenyl)thio]acetic acid 4-[2-[(4-hydroxy-3-methyl-phenyl)thio]acetyl]oxybutyl ester Formula: C22H26O6S2 MolecularWeight: 450.56824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCC(=O)OCCCCOC(=O)CSC2=CC(=C(C=C2)O)C)O

Isomeric SMILES

CC1=C(C=CC(=C1)SCC(=O)OCCCCOC(=O)CSC2=CC(=C(C=C2)O)C)O

InChI

InChI=1S/C22H26O6S2/c1-15-11-17(5-7-19(15)23)29-13-21(25)27-9-3-4-10-28-22(26)14-30-18-6-8-20(24)16(2)12-18/h5-8,11-12,23-24H,3-4,9-10,13-14H2,1-2H3