dioctyltin(2+); 2-ethylhexyl 2-sulfanylethanoate

Systemtic Name: dioctyltin(2+); 2-ethylhexyl 2-sulfanylethanoate Openeye Name: dioctyltin(2+); 2-ethylhexyl 2-sulfanylacetate CAS Name: dioctyltin(2+); 2-mercaptoacetic acid 2-ethylhexyl ester IUPAC Name: dioctyltin(2+); 2-ethylhexyl 2-sulfanylacetate Traditional Name: dioctyltin(2+); 2-mercaptoacetic acid 2-ethylhexyl ester Formula: C46H94O6S3Sn+2 MolecularWeight: 958.13996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)COC(=O)CS.CCCCC(CC)COC(=O)CS.CCCCC(CC)COC(=O)CS

Isomeric SMILES

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)COC(=O)CS.CCCCC(CC)COC(=O)CS.CCCCC(CC)COC(=O)CS

InChI

InChI=1S/3C10H20O2S.2C8H17.Sn/c3*1-3-5-6-9(4-2)7-12-10(11)8-13;2*1-3-5-7-8-6-4-2;/h3*9,13H,3-8H2,1-2H3;2*1,3-8H2,2H3;/q;;;;;+2