10-methyl-2-sulfanyl-undecanoate; methyltin(3+)

Systemtic Name: 10-methyl-2-sulfanyl-undecanoate; methyltin(3+) Openeye Name: 10-methyl-2-sulfanyl-undecanoate; methyltin(3+) CAS Name: 2-mercapto-10-methylundecanoate; methyltin(3+) IUPAC Name: 10-methyl-2-sulfanylundecanoate; methyltin(3+) Traditional Name: 2-mercapto-10-methyl-undecanoate; methyltin(3+) Formula: C37H72O6S3Sn MolecularWeight: 827.86898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCC(C(=O)[O-])S.CC(C)CCCCCCCC(C(=O)[O-])S.CC(C)CCCCCCCC(C(=O)[O-])S.C[Sn+3]

Isomeric SMILES

CC(C)CCCCCCCC(C(=O)[O-])S.CC(C)CCCCCCCC(C(=O)[O-])S.CC(C)CCCCCCCC(C(=O)[O-])S.C[Sn+3]

InChI

InChI=1S/3C12H24O2S.CH3.Sn/c3*1-10(2)8-6-4-3-5-7-9-11(15)12(13)14;;/h3*10-11,15H,3-9H2,1-2H3,(H,13,14);1H3;/q;;;;+3/p-3