2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoic acid; dibutyltin

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoic acid; dibutyltin Openeye Name: dibutyltin; 2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoic acid CAS Name: dibutyltin; 2-(1,3-dioxo-2-isoindolyl)-4-methylpentanoic acid IUPAC Name: dibutyltin; 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoic acid Traditional Name: dibutyltin; 4-methyl-2-phthalimido-valeric acid Formula: C36H48N2O8Sn MolecularWeight: 755.48492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn]CCCC.CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCC[Sn]CCCC.CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O.CC(C)CC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/2C14H15NO4.2C4H9.Sn/c2*1-8(2)7-11(14(18)19)15-12(16)9-5-3-4-6-10(9)13(15)17;2*1-3-4-2;/h2*3-6,8,11H,7H2,1-2H3,(H,18,19);2*1,3-4H2,2H3;