7,7-dimethyloctanoate; gadolinium(3+)

Systemtic Name: 7,7-dimethyloctanoate; gadolinium(3+) Openeye Name: 7,7-dimethyloctanoate; gadolinium(3+) CAS Name: 7,7-dimethyloctanoate; gadolinium(3+) IUPAC Name: 7,7-dimethyloctanoate; gadolinium(3+) Traditional Name: 7,7-dimethylcaprylate; gadolinium(3+) Formula: C30H57GdO6 MolecularWeight: 671.01998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Gd+3]

Isomeric SMILES

CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Gd+3]

InChI

InChI=1S/3C10H20O2.Gd/c3*1-10(2,3)8-6-4-5-7-9(11)12;/h3*4-8H2,1-3H3,(H,11,12);/q;;;+3/p-3