bis(3-oxidanylidenebutyl)tin(2+); 2-(2-sulfanylethyl)octanoate; sulfide

Systemtic Name: bis(3-oxidanylidenebutyl)tin(2+); 2-(2-sulfanylethyl)octanoate; sulfide Openeye Name: bis(3-oxobutyl)tin(2+); 2-(2-sulfanylethyl)octanoate; sulfide CAS Name: bis(3-oxobutyl)tin(2+); 2-(2-mercaptoethyl)octanoate; sulfide IUPAC Name: bis(3-oxobutyl)tin(2+); 2-(2-sulfanylethyl)octanoate; sulfide Traditional Name: bis(3-ketobutyl)tin(2+); 2-(2-mercaptoethyl)caprylate; sulfide Formula: C36H66O8S3Sn2 MolecularWeight: 960.51944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCS)C(=O)[O-].CCCCCCC(CCS)C(=O)[O-].CC(=O)CC[Sn+2]CCC(=O)C.CC(=O)CC[Sn+2]CCC(=O)C.[S-2]

Isomeric SMILES

CCCCCCC(CCS)C(=O)[O-].CCCCCCC(CCS)C(=O)[O-].CC(=O)CC[Sn+2]CCC(=O)C.CC(=O)CC[Sn+2]CCC(=O)C.[S-2]

InChI

InChI=1S/2C10H20O2S.4C4H7O.S.2Sn/c2*1-2-3-4-5-6-9(7-8-13)10(11)12;4*1-3-4(2)5;;;/h2*9,13H,2-8H2,1H3,(H,11,12);4*1,3H2,2H3;;;/q;;;;;;-2;2*+2/p-2