butyltin(3+); 8-methyl-2-sulfanyl-nonanoate; sulfide

Systemtic Name: butyltin(3+); 8-methyl-2-sulfanyl-nonanoate; sulfide Openeye Name: butyltin(3+); 8-methyl-2-sulfanyl-nonanoate; sulfide CAS Name: butyltin(3+); 2-mercapto-8-methylnonanoate; sulfide IUPAC Name: butyltin(3+); 8-methyl-2-sulfanylnonanoate; sulfide Traditional Name: butyltin(3+); 2-mercapto-8-methyl-pelargonate; sulfide Formula: C14H28O2S2Sn MolecularWeight: 411.21092

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+3].CC(C)CCCCCC(C(=O)[O-])S.[S-2]

Isomeric SMILES

CCCC[Sn+3].CC(C)CCCCCC(C(=O)[O-])S.[S-2]

InChI

InChI=1S/C10H20O2S.C4H9.S.Sn/c1-8(2)6-4-3-5-7-9(13)10(11)12;1-3-4-2;;/h8-9,13H,3-7H2,1-2H3,(H,11,12);1,3-4H2,2H3;;/q;;-2;+3/p-1