butane-1,4-diol; dibutyltin(2+); 3-sulfanylpropanoate

Systemtic Name: butane-1,4-diol; dibutyltin(2+); 3-sulfanylpropanoate Openeye Name: butane-1,4-diol; dibutyltin(2+); 3-sulfanylpropanoate CAS Name: butane-1,4-diol; dibutyltin(2+); 3-mercaptopropanoate IUPAC Name: butane-1,4-diol; dibutyltin(2+); 3-sulfanylpropanoate Traditional Name: butane-1,4-diol; dibutyltin(2+); 3-mercaptopropionate Formula: C18H38O6S2Sn MolecularWeight: 533.33072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+2]CCCC.C(CCO)CO.C(CS)C(=O)[O-].C(CS)C(=O)[O-]

Isomeric SMILES

CCCC[Sn+2]CCCC.C(CCO)CO.C(CS)C(=O)[O-].C(CS)C(=O)[O-]

InChI

InChI=1S/C4H10O2.2C4H9.2C3H6O2S.Sn/c5-3-1-2-4-6;2*1-3-4-2;2*4-3(5)1-2-6;/h5-6H,1-4H2;2*1,3-4H2,2H3;2*6H,1-2H2,(H,4,5);/q;;;;;+2/p-2