(4-dodecylphenyl) [1-(4-methylsulfanylphenyl)-1-oxidanylidene-propan-2-yl] sulfite

Systemtic Name: (4-dodecylphenyl) [1-(4-methylsulfanylphenyl)-1-oxidanylidene-propan-2-yl] sulfite Openeye Name: (4-dodecylphenyl) [1-methyl-2-(4-methylsulfanylphenyl)-2-oxo-ethyl] sulfite CAS Name: sulfurous acid (4-dodecylphenyl) [1-[4-(methylthio)phenyl]-1-oxopropan-2-yl] ester IUPAC Name: (4-dodecylphenyl) [1-(4-methylsulfanylphenyl)-1-oxopropan-2-yl] sulfite Traditional Name: sulfurous acid [2-keto-1-methyl-2-[4-(methylthio)phenyl]ethyl] (4-laurylphenyl) ester Formula: C28H40O4S2 MolecularWeight: 504.7448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OS(=O)OC(C)C(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OS(=O)OC(C)C(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C28H40O4S2/c1-4-5-6-7-8-9-10-11-12-13-14-24-15-19-26(20-16-24)32-34(30)31-23(2)28(29)25-17-21-27(33-3)22-18-25/h15-23H,4-14H2,1-3H3