octyltin(3+); 2-sulfanylethyl octanoate

Systemtic Name: octyltin(3+); 2-sulfanylethyl octanoate Openeye Name: octyltin(3+); 2-sulfanylethyl octanoate CAS Name: octanoic acid 2-mercaptoethyl ester; octyltin(3+) IUPAC Name: octyltin(3+); 2-sulfanylethyl octanoate Traditional Name: caprylic acid 2-mercaptoethyl ester; octyltin(3+) Formula: C38H77O6S3Sn+3 MolecularWeight: 844.91938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+3].CCCCCCCC(=O)OCCS.CCCCCCCC(=O)OCCS.CCCCCCCC(=O)OCCS

Isomeric SMILES

CCCCCCCC[Sn+3].CCCCCCCC(=O)OCCS.CCCCCCCC(=O)OCCS.CCCCCCCC(=O)OCCS

InChI

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