O2-[2-[methyl-bis[2-[2-(6-methylheptoxycarbonyl)phenyl]carbonyloxyethylsulfanyl]stannyl]sulfanylethyl] O1-(6-methylheptyl) benzene-1,2-dicarboxylate

Systemtic Name: O2-[2-[methyl-bis[2-[2-(6-methylheptoxycarbonyl)phenyl]carbonyloxyethylsulfanyl]stannyl]sulfanylethyl] O1-(6-methylheptyl) benzene-1,2-dicarboxylate Openeye Name: O2-[2-[methyl-bis[2-[2-(6-methylheptoxycarbonyl)benzoyl]oxyethylsulfanyl]stannyl]sulfanylethyl] O1-(6-methylheptyl) benzene-1,2-dicarboxylate CAS Name: benzene-1,2-dicarboxylic acid O2-[2-[[methyl-bis[2-[[2-[6-methylheptoxy(oxo)methyl]phenyl]-oxomethoxy]ethylthio]stannyl]thio]ethyl] ester O1-(6-methylheptyl) ester IUPAC Name: 2-O-[2-[methyl-bis[2-[2-(6-methylheptoxycarbonyl)benzoyl]oxyethylsulfanyl]stannyl]sulfanylethyl] 1-O-(6-methylheptyl) benzene-1,2-dicarboxylate Traditional Name: benzene-1,2-dicarboxylic acid O2-[2-[[methyl-bis[2-[2-(6-methylheptoxycarbonyl)benzoyl]oxyethylthio]stannyl]thio]ethyl] ester O1-(6-methylheptyl) ester Formula: C55H78O12S3Sn MolecularWeight: 1146.10562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCS[Sn](C)(SCCOC(=O)C2=CC=CC=C2C(=O)OCCCCCC(C)C)SCCOC(=O)C3=CC=CC=C3C(=O)OCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCS[Sn](C)(SCCOC(=O)C2=CC=CC=C2C(=O)OCCCCCC(C)C)SCCOC(=O)C3=CC=CC=C3C(=O)OCCCCCC(C)C

InChI

InChI=1S/3C18H26O4S.CH3.Sn/c3*1-14(2)8-4-3-7-11-21-17(19)15-9-5-6-10-16(15)18(20)22-12-13-23;;/h3*5-6,9-10,14,23H,3-4,7-8,11-13H2,1-2H3;1H3;/q;;;;+3/p-3