dibutyltin(2+); dodecanoate; methylbenzene

Systemtic Name: dibutyltin(2+); dodecanoate; methylbenzene Openeye Name: dibutyltin(2+); dodecanoate; toluene CAS Name: dibutyltin(2+); dodecanoate; toluene IUPAC Name: dibutyltin(2+); dodecanoate; toluene Traditional Name: dibutyltin(2+); laurate; toluene Formula: C39H72O4Sn MolecularWeight: 723.69658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC.CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCC[Sn+2]CCCC.CC1=CC=CC=C1

InChI

InChI=1S/2C12H24O2.C7H8.2C4H9.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-7-5-3-2-4-6-7;2*1-3-4-2;/h2*2-11H2,1H3,(H,13,14);2-6H,1H3;2*1,3-4H2,2H3;/q;;;;;+2/p-2