butyltin(3+); 3-ethoxycarbonylpyrazine-2-carboxylate; dichloride

Systemtic Name: butyltin(3+); 3-ethoxycarbonylpyrazine-2-carboxylate; dichloride Openeye Name: butyltin(3+); 3-ethoxycarbonylpyrazine-2-carboxylate; dichloride CAS Name: butyltin(3+); 3-ethoxycarbonyl-2-pyrazinecarboxylate; dichloride IUPAC Name: butyltin(3+); 3-ethoxycarbonylpyrazine-2-carboxylate; dichloride Traditional Name: butyltin(3+); 3-carbethoxypyrazinate; dichloride Formula: C12H16Cl2N2O4Sn MolecularWeight: 441.88244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn+3].CCOC(=O)C1=NC=CN=C1C(=O)[O-].[Cl-].[Cl-]

Isomeric SMILES

CCCC[Sn+3].CCOC(=O)C1=NC=CN=C1C(=O)[O-].[Cl-].[Cl-]

InChI

InChI=1S/C8H8N2O4.C4H9.2ClH.Sn/c1-2-14-8(13)6-5(7(11)12)9-3-4-10-6;1-3-4-2;;;/h3-4H,2H2,1H3,(H,11,12);1,3-4H2,2H3;2*1H;/q;;;;+3/p-3