dipropyltin(2+); (E)-4-(6-methylheptoxy)-4-oxidanylidene-but-2-enoate

Systemtic Name: dipropyltin(2+); (E)-4-(6-methylheptoxy)-4-oxidanylidene-but-2-enoate Openeye Name: dipropyltin(2+); (E)-4-(6-methylheptoxy)-4-oxo-but-2-enoate CAS Name: dipropyltin(2+); (E)-4-(6-methylheptoxy)-4-oxo-2-butenoate IUPAC Name: dipropyltin(2+); (E)-4-(6-methylheptoxy)-4-oxobut-2-enoate Traditional Name: dipropyltin(2+); (E)-4-keto-4-(6-methylheptoxy)but-2-enoate Formula: C30H52O8Sn MolecularWeight: 659.43908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[Sn+2]CCC.CC(C)CCCCCOC(=O)C=CC(=O)[O-].CC(C)CCCCCOC(=O)C=CC(=O)[O-]

Isomeric SMILES

CCC[Sn+2]CCC.CC(CCCCCOC(=O)/C=C/C(=O)[O-])C.CC(CCCCCOC(=O)/C=C/C(=O)[O-])C

InChI

InChI=1S/2C12H20O4.2C3H7.Sn/c2*1-10(2)6-4-3-5-9-16-12(15)8-7-11(13)14;2*1-3-2;/h2*7-8,10H,3-6,9H2,1-2H3,(H,13,14);2*1,3H2,2H3;/q;;;;+2/p-2/b2*8-7+;;;