dioctyltin(2+); (E)-hept-2-ene; 4-oxidanidyl-2-oxidanyl-4-sulfanylidene-butanoate

Systemtic Name: dioctyltin(2+); (E)-hept-2-ene; 4-oxidanidyl-2-oxidanyl-4-sulfanylidene-butanoate Openeye Name: dioctyltin(2+); (E)-hept-2-ene; 2-hydroxy-4-oxido-4-thioxo-butanoate CAS Name: dioctyltin(2+); (E)-2-heptene; 2-hydroxy-4-oxido-4-sulfanylidenebutanoate IUPAC Name: dioctyltin(2+); (E)-hept-2-ene; 2-hydroxy-4-oxido-4-sulfanylidenebutanoate Traditional Name: dioctyltin(2+); (E)-hept-2-ene; 2-hydroxy-4-oxido-4-thioxo-butyrate Formula: C27H52O4SSn MolecularWeight: 591.47438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC=CC.C(C(C(=O)[O-])O)C(=S)[O-]

Isomeric SMILES

CCCCCCCC[Sn+2]CCCCCCCC.CCCC/C=C/C.C(C(C(=O)[O-])O)C(=S)[O-]

InChI

InChI=1S/2C8H17.C7H14.C4H6O4S.Sn/c2*1-3-5-7-8-6-4-2;1-3-5-7-6-4-2;5-2(4(7)8)1-3(6)9;/h2*1,3-8H2,2H3;3,5H,4,6-7H2,1-2H3;2,5H,1H2,(H,6,9)(H,7,8);/q;;;;+2/p-2/b;;5-3+;;