dialuminum 2-(tetradecanoylamino)pentanedioate

Systemtic Name: dialuminum 2-(tetradecanoylamino)pentanedioate Openeye Name: dialuminum 2-(tetradecanoylamino)pentanedioate CAS Name: dialuminum 2-(1-oxotetradecylamino)pentanedioate IUPAC Name: dialuminum 2-(tetradecanoylamino)pentanedioate Traditional Name: dialuminum 2-(tetradecanoylamino)glutarate Formula: C57H99Al2N3O15 MolecularWeight: 1120.370136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].CCCCCCCCCCCCCC(=O)NC(CCC(=O)[O-])C(=O)[O-].[Al+3].[Al+3]

InChI

InChI=1S/3C19H35NO5.2Al/c3*1-2-3-4-5-6-7-8-9-10-11-12-13-17(21)20-16(19(24)25)14-15-18(22)23;;/h3*16H,2-15H2,1H3,(H,20,21)(H,22,23)(H,24,25);;/q;;;2*+3/p-6