gadolinium(3+); 4-[2-(2-methylprop-2-enoyloxy)ethoxy]-4-oxidanylidene-butanoate

Systemtic Name: gadolinium(3+); 4-[2-(2-methylprop-2-enoyloxy)ethoxy]-4-oxidanylidene-butanoate Openeye Name: gadolinium(3+); 4-[2-(2-methylprop-2-enoyloxy)ethoxy]-4-oxo-butanoate CAS Name: gadolinium(3+); 4-[2-(2-methyl-1-oxoprop-2-enoxy)ethoxy]-4-oxobutanoate IUPAC Name: gadolinium(3+); 4-[2-(2-methylprop-2-enoyloxy)ethoxy]-4-oxobutanoate Traditional Name: gadolinium(3+); 4-keto-4-(2-methacryloyloxyethoxy)butyrate Formula: C30H39GdO18 MolecularWeight: 844.86986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C10H14O6.Gd/c3*1-7(2)10(14)16-6-5-15-9(13)4-3-8(11)12;/h3*1,3-6H2,2H3,(H,11,12);/q;;;+3/p-3