2-ethylhexane-1-thiolate; methyltin(3+)

Systemtic Name: 2-ethylhexane-1-thiolate; methyltin(3+) Openeye Name: 2-ethylhexane-1-thiolate; methyltin(3+) CAS Name: 2-ethyl-1-hexanethiolate; methyltin(3+) IUPAC Name: 2-ethylhexane-1-thiolate; methyltin(3+) Traditional Name: 2-ethylhexane-1-thiolate; methyltin(3+) Formula: C25H54S3Sn MolecularWeight: 569.60126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C8H18S.CH3.Sn/c3*1-3-5-6-8(4-2)7-9;;/h3*8-9H,3-7H2,1-2H3;1H3;/q;;;;+3/p-3