dioctyltin(2+); 4-ethyl-2-sulfanyl-octanoate

Systemtic Name: dioctyltin(2+); 4-ethyl-2-sulfanyl-octanoate Openeye Name: dioctyltin(2+); 4-ethyl-2-sulfanyl-octanoate CAS Name: dioctyltin(2+); 4-ethyl-2-mercaptooctanoate IUPAC Name: dioctyltin(2+); 4-ethyl-2-sulfanyloctanoate Traditional Name: dioctyltin(2+); 4-ethyl-2-mercapto-caprylate Formula: C36H72O4S2Sn MolecularWeight: 751.79448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)CC(C(=O)[O-])S.CCCCC(CC)CC(C(=O)[O-])S

Isomeric SMILES

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)CC(C(=O)[O-])S.CCCCC(CC)CC(C(=O)[O-])S

InChI

InChI=1S/2C10H20O2S.2C8H17.Sn/c2*1-3-5-6-8(4-2)7-9(13)10(11)12;2*1-3-5-7-8-6-4-2;/h2*8-9,13H,3-7H2,1-2H3,(H,11,12);2*1,3-8H2,2H3;/q;;;;+2/p-2