bis(3-butoxy-3-oxidanylidene-propyl)tin(2+); 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate

Systemtic Name: bis(3-butoxy-3-oxidanylidene-propyl)tin(2+); 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate Openeye Name: bis(3-butoxy-3-oxo-propyl)tin(2+); 8-methyl-2-(6-methylheptyl)-2-sulfanyl-nonanoate CAS Name: bis(3-butoxy-3-oxopropyl)tin(2+); 2-mercapto-8-methyl-2-(6-methylheptyl)nonanoate IUPAC Name: bis(3-butoxy-3-oxopropyl)tin(2+); 8-methyl-2-(6-methylheptyl)-2-sulfanylnonanoate Traditional Name: bis(3-butoxy-3-keto-propyl)tin(2+); 2-mercapto-8-methyl-2-(6-methylheptyl)pelargonate Formula: C50H96O8S2Sn MolecularWeight: 1008.13244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC[Sn+2]CCC(=O)OCCCC.CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])S.CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])S

Isomeric SMILES

CCCCOC(=O)CC[Sn+2]CCC(=O)OCCCC.CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])S.CC(C)CCCCCC(CCCCCC(C)C)(C(=O)[O-])S

InChI

InChI=1S/2C18H36O2S.2C7H13O2.Sn/c2*1-15(2)11-7-5-9-13-18(21,17(19)20)14-10-6-8-12-16(3)4;2*1-3-5-6-9-7(8)4-2;/h2*15-16,21H,5-14H2,1-4H3,(H,19,20);2*2-6H2,1H3;/q;;;;+2/p-2