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octyltin(3+); 2-sulfanylethanoate

octyltin(3+); 2-sulfanylethanoate

Systemtic Name:octyltin(3+); 2-sulfanylethanoate
Openeye Name:octyltin(3+); 2-sulfanylacetate
CAS Name:2-mercaptoacetate; octyltin(3+)
IUPAC Name:octyltin(3+); 2-sulfanylacetate
Traditional Name:2-mercaptoacetate; octyltin(3+)
Formula: C14H26O6S3Sn
MolecularWeight: 505.25764
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+3].C(C(=O)[O-])S.C(C(=O)[O-])S.C(C(=O)[O-])S


Isomeric SMILES

CCCCCCCC[Sn+3].C(C(=O)[O-])S.C(C(=O)[O-])S.C(C(=O)[O-])S


InChI

InChI=1S/C8H17.3C2H4O2S.Sn/c1-3-5-7-8-6-4-2;3*3-2(4)1-5;/h1,3-8H2,2H3;3*5H,1H2,(H,3,4);/q;;;;+3/p-3


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