butyl 3-[[3-[(3-butoxy-3-oxidanylidene-propyl)sulfanylmethyl]-5-methyl-2-oxidanyl-phenyl]methylsulfanyl]propanoate

Systemtic Name: butyl 3-[[3-[(3-butoxy-3-oxidanylidene-propyl)sulfanylmethyl]-5-methyl-2-oxidanyl-phenyl]methylsulfanyl]propanoate Openeye Name: butyl 3-[[3-[(3-butoxy-3-oxo-propyl)sulfanylmethyl]-2-hydroxy-5-methyl-phenyl]methylsulfanyl]propanoate CAS Name: 3-[[3-[[(3-butoxy-3-oxopropyl)thio]methyl]-2-hydroxy-5-methylphenyl]methylthio]propanoic acid butyl ester IUPAC Name: butyl 3-[[3-[(3-butoxy-3-oxopropyl)sulfanylmethyl]-2-hydroxy-5-methylphenyl]methylsulfanyl]propanoate Traditional Name: 3-[[3-[[(3-butoxy-3-keto-propyl)thio]methyl]-2-hydroxy-5-methyl-benzyl]thio]propionic acid butyl ester Formula: C23H36O5S2 MolecularWeight: 456.65894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCSCC1=CC(=CC(=C1O)CSCCC(=O)OCCCC)C

Isomeric SMILES

CCCCOC(=O)CCSCC1=CC(=CC(=C1O)CSCCC(=O)OCCCC)C

InChI

InChI=1S/C23H36O5S2/c1-4-6-10-27-21(24)8-12-29-16-19-14-18(3)15-20(23(19)26)17-30-13-9-22(25)28-11-7-5-2/h14-15,26H,4-13,16-17H2,1-3H3