dibutyltin(2+); dodecanoate; 2-oxidanylbutanedioate

Systemtic Name: dibutyltin(2+); dodecanoate; 2-oxidanylbutanedioate Openeye Name: dibutyltin(2+); dodecanoate; 2-hydroxybutanedioate CAS Name: dibutyltin(2+); dodecanoate; 2-hydroxybutanedioate IUPAC Name: dibutyltin(2+); dodecanoate; 2-hydroxybutanedioate Traditional Name: dibutyltin(2+); 2-hydroxysuccinate; laurate Formula: C56H108O14Sn3 MolecularWeight: 1361.57832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C(C(C(=O)[O-])O)C(=O)[O-].C(C(C(=O)[O-])O)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.CCCC[Sn+2]CCCC.C(C(C(=O)[O-])O)C(=O)[O-].C(C(C(=O)[O-])O)C(=O)[O-]

InChI

InChI=1S/2C12H24O2.2C4H6O5.6C4H9.3Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12(13)14;2*5-2(4(8)9)1-3(6)7;6*1-3-4-2;;;/h2*2-11H2,1H3,(H,13,14);2*2,5H,1H2,(H,6,7)(H,8,9);6*1,3-4H2,2H3;;;/q;;;;;;;;;;3*+2/p-6