tributyltin; 2-[2,4,5-tris(chloranyl)phenoxy]propanoic acid

Systemtic Name: tributyltin; 2-[2,4,5-tris(chloranyl)phenoxy]propanoic acid Openeye Name: tributyltin; 2-(2,4,5-trichlorophenoxy)propanoic acid CAS Name: tributyltin; 2-(2,4,5-trichlorophenoxy)propanoic acid IUPAC Name: tributyltin; 2-(2,4,5-trichlorophenoxy)propanoic acid Traditional Name: tributyltin; 2-(2,4,5-trichlorophenoxy)propionic acid Formula: C21H34Cl3O3Sn MolecularWeight: 559.56186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)CCCC.CC(C(=O)O)OC1=CC(=C(C=C1Cl)Cl)Cl

Isomeric SMILES

CCCC[Sn](CCCC)CCCC.CC(C(=O)O)OC1=CC(=C(C=C1Cl)Cl)Cl

InChI

InChI=1S/C9H7Cl3O3.3C4H9.Sn/c1-4(9(13)14)15-8-3-6(11)5(10)2-7(8)12;3*1-3-4-2;/h2-4H,1H3,(H,13,14);3*1,3-4H2,2H3;