dibutyltin; 2-(6-methylheptylsulfanyl)ethanoic acid

Systemtic Name: dibutyltin; 2-(6-methylheptylsulfanyl)ethanoic acid Openeye Name: dibutyltin; 2-(6-methylheptylsulfanyl)acetic acid CAS Name: dibutyltin; 2-(6-methylheptylthio)acetic acid IUPAC Name: dibutyltin; 2-(6-methylheptylsulfanyl)acetic acid Traditional Name: dibutyltin; 2-(6-methylheptylthio)acetic acid Formula: C28H58O4S2Sn MolecularWeight: 641.59772

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.CC(C)CCCCCSCC(=O)O.CC(C)CCCCCSCC(=O)O

Isomeric SMILES

CCCC[Sn]CCCC.CC(C)CCCCCSCC(=O)O.CC(C)CCCCCSCC(=O)O

InChI

InChI=1S/2C10H20O2S.2C4H9.Sn/c2*1-9(2)6-4-3-5-7-13-8-10(11)12;2*1-3-4-2;/h2*9H,3-8H2,1-2H3,(H,11,12);2*1,3-4H2,2H3;