O4-[dibutyl(phenylcarbonylsulfanyl)stannyl] O1-(2-ethylhexyl) (Z)-but-2-enedioate

Systemtic Name: O4-[dibutyl(phenylcarbonylsulfanyl)stannyl] O1-(2-ethylhexyl) (Z)-but-2-enedioate Openeye Name: O4-[benzoylsulfanyl(dibutyl)stannyl] O1-(2-ethylhexyl) (Z)-but-2-enedioate CAS Name: (Z)-2-butenedioic acid O4-[(benzoylthio)-dibutylstannyl] ester O1-(2-ethylhexyl) ester IUPAC Name: 4-O-[benzoylsulfanyl(dibutyl)stannyl] 1-O-(2-ethylhexyl) (Z)-but-2-enedioate Traditional Name: (Z)-but-2-enedioic acid O4-[(benzoylthio)-dibutyl-stannyl] ester O1-(2-ethylhexyl) ester Formula: C27H42O5SSn MolecularWeight: 597.39438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C=CC(=O)O[Sn](CCCC)(CCCC)SC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC(CC)COC(=O)/C=C\C(=O)O[Sn](CCCC)(CCCC)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H20O4.C7H6OS.2C4H9.Sn/c1-3-5-6-10(4-2)9-16-12(15)8-7-11(13)14;8-7(9)6-4-2-1-3-5-6;2*1-3-4-2;/h7-8,10H,3-6,9H2,1-2H3,(H,13,14);1-5H,(H,8,9);2*1,3-4H2,2H3;/q;;;;+2/p-2/b8-7-;;;;