2-methylpropanoate; octyltin(3+)

Systemtic Name: 2-methylpropanoate; octyltin(3+) Openeye Name: 2-methylpropanoate; octyltin(3+) CAS Name: 2-methylpropanoate; octyltin(3+) IUPAC Name: 2-methylpropanoate; octyltin(3+) Traditional Name: octyltin(3+) triisobutyrate Formula: C20H38O6Sn MolecularWeight: 493.22212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H17.3C4H8O2.Sn/c1-3-5-7-8-6-4-2;3*1-3(2)4(5)6;/h1,3-8H2,2H3;3*3H,1-2H3,(H,5,6);/q;;;;+3/p-3