dibutyltin(2+); 2-ethyl-2-sulfanyl-octanoate

Systemtic Name: dibutyltin(2+); 2-ethyl-2-sulfanyl-octanoate Openeye Name: dibutyltin(2+); 2-ethyl-2-sulfanyl-octanoate CAS Name: dibutyltin(2+); 2-ethyl-2-mercaptooctanoate IUPAC Name: dibutyltin(2+); 2-ethyl-2-sulfanyloctanoate Traditional Name: dibutyltin(2+); 2-ethyl-2-mercapto-caprylate Formula: C28H56O4S2Sn MolecularWeight: 639.58184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC)(C(=O)[O-])S.CCCCCCC(CC)(C(=O)[O-])S.CCCC[Sn+2]CCCC

Isomeric SMILES

CCCCCCC(CC)(C(=O)[O-])S.CCCCCCC(CC)(C(=O)[O-])S.CCCC[Sn+2]CCCC

InChI

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