dodecanoate; 2-ethyl-3-oxidanylidene-butanoate; tin(4+)

Systemtic Name: dodecanoate; 2-ethyl-3-oxidanylidene-butanoate; tin(4+) Openeye Name: stannic; dodecanoate; 2-ethyl-3-oxo-butanoate CAS Name: dodecanoate; 2-ethyl-3-oxobutanoate; tin(4+) IUPAC Name: dodecanoate; 2-ethyl-3-oxobutanoate; tin(4+) Traditional Name: stannic; 2-ethyl-3-keto-butyrate; laurate Formula: C36H59O14Sn- MolecularWeight: 834.55526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].[Sn+4]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].CCC(C(=O)C)C(=O)[O-].[Sn+4]

InChI

InChI=1S/C12H24O2.4C6H10O3.Sn/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;4*1-3-5(4(2)7)6(8)9;/h2-11H2,1H3,(H,13,14);4*5H,3H2,1-2H3,(H,8,9);/q;;;;;+4/p-5