aluminum 4,4-dibutyl-3-oxidanylidene-octanoate

Systemtic Name: aluminum 4,4-dibutyl-3-oxidanylidene-octanoate Openeye Name: aluminum 4,4-dibutyl-3-oxo-octanoate CAS Name: aluminum 4,4-dibutyl-3-oxooctanoate IUPAC Name: aluminum 4,4-dibutyl-3-oxooctanoate Traditional Name: aluminum 4,4-dibutyl-3-keto-caprylate Formula: C48H87AlO9 MolecularWeight: 835.180518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].[Al+3]

Isomeric SMILES

CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].CCCCC(CCCC)(CCCC)C(=O)CC(=O)[O-].[Al+3]

InChI

InChI=1S/3C16H30O3.Al/c3*1-4-7-10-16(11-8-5-2,12-9-6-3)14(17)13-15(18)19;/h3*4-13H2,1-3H3,(H,18,19);/q;;;+3/p-3