butyltin(3+); 6-methylheptyl 2-sulfanylethanoate

Systemtic Name: butyltin(3+); 6-methylheptyl 2-sulfanylethanoate Openeye Name: butyltin(3+); 6-methylheptyl 2-sulfanylacetate CAS Name: butyltin(3+); 2-mercaptoacetic acid 6-methylheptyl ester IUPAC Name: butyltin(3+); 6-methylheptyl 2-sulfanylacetate Traditional Name: butyltin(3+); 2-mercaptoacetic acid 6-methylheptyl ester Formula: C34H69O6S3Sn+3 MolecularWeight: 788.81306

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+3].CC(C)CCCCCOC(=O)CS.CC(C)CCCCCOC(=O)CS.CC(C)CCCCCOC(=O)CS

Isomeric SMILES

CCCC[Sn+3].CC(C)CCCCCOC(=O)CS.CC(C)CCCCCOC(=O)CS.CC(C)CCCCCOC(=O)CS

InChI

InChI=1S/3C10H20O2S.C4H9.Sn/c3*1-9(2)6-4-3-5-7-12-10(11)8-13;1-3-4-2;/h3*9,13H,3-8H2,1-2H3;1,3-4H2,2H3;/q;;;;+3