2-(2-ethylhexoxy)-2-oxidanylidene-ethanethiolate; methyltin(3+)

Systemtic Name: 2-(2-ethylhexoxy)-2-oxidanylidene-ethanethiolate; methyltin(3+) Openeye Name: 2-(2-ethylhexoxy)-2-oxo-ethanethiolate; methyltin(3+) CAS Name: 2-(2-ethylhexoxy)-2-oxoethanethiolate; methyltin(3+) IUPAC Name: 2-(2-ethylhexoxy)-2-oxoethanethiolate; methyltin(3+) Traditional Name: 2-(2-ethylhexoxy)-2-keto-ethanethiolate; methyltin(3+) Formula: C31H60O6S3Sn MolecularWeight: 743.7095

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].C[Sn+3]

Isomeric SMILES

CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].C[Sn+3]

InChI

InChI=1S/3C10H20O2S.CH3.Sn/c3*1-3-5-6-9(4-2)7-12-10(11)8-13;;/h3*9,13H,3-8H2,1-2H3;1H3;/q;;;;+3/p-3