dibutyltin(2+); 2-octyl-2-sulfanyl-decanoate

Systemtic Name: dibutyltin(2+); 2-octyl-2-sulfanyl-decanoate Openeye Name: dibutyltin(2+); 2-octyl-2-sulfanyl-decanoate CAS Name: dibutyltin(2+); 2-mercapto-2-octyldecanoate IUPAC Name: dibutyltin(2+); 2-octyl-2-sulfanyldecanoate Traditional Name: dibutyltin(2+); 2-mercapto-2-octyl-caprate Formula: C44H88O4S2Sn MolecularWeight: 864.00712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)(C(=O)[O-])S.CCCCCCCCC(CCCCCCCC)(C(=O)[O-])S.CCCC[Sn+2]CCCC

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)(C(=O)[O-])S.CCCCCCCCC(CCCCCCCC)(C(=O)[O-])S.CCCC[Sn+2]CCCC

InChI

InChI=1S/2C18H36O2S.2C4H9.Sn/c2*1-3-5-7-9-11-13-15-18(21,17(19)20)16-14-12-10-8-6-4-2;2*1-3-4-2;/h2*21H,3-16H2,1-2H3,(H,19,20);2*1,3-4H2,2H3;/q;;;;+2/p-2