(3-methyl-6-oxidanyl-octan-4-yl) 3-oxidanylidenebutanoate; yttrium(3+)

Systemtic Name: (3-methyl-6-oxidanyl-octan-4-yl) 3-oxidanylidenebutanoate; yttrium(3+) Openeye Name: [3-hydroxy-1-(1-methylpropyl)pentyl] 3-oxobutanoate; yttrium(3+) CAS Name: 3-oxobutanoic acid (6-hydroxy-3-methyloctan-4-yl) ester; yttrium(3+) IUPAC Name: (6-hydroxy-3-methyloctan-4-yl) 3-oxobutanoate; yttrium(3+) Traditional Name: 3-ketobutyric acid [3-hydroxy-1-(1-methylpropyl)pentyl] ester; yttrium(3+) Formula: C13H23O4Y+2 MolecularWeight: 332.22517

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(C)[CH-]C)OC(=O)CC(=O)C)O.[Y+3]

Isomeric SMILES

CCC(CC(C(C)[CH-]C)OC(=O)CC(=O)C)O.[Y+3]

InChI

InChI=1S/C13H23O4.Y/c1-5-9(3)12(8-11(15)6-2)17-13(16)7-10(4)14;/h5,9,11-12,15H,6-8H2,1-4H3;/q-1;+3