6-oxidanyl-5,8-bis(oxidanylidene)-7-(2-oxidanylidenepropyl)nonacosan-7-olate

Systemtic Name: 6-oxidanyl-5,8-bis(oxidanylidene)-7-(2-oxidanylidenepropyl)nonacosan-7-olate Openeye Name: 7-acetonyl-6-hydroxy-5,8-dioxo-nonacosan-7-olate CAS Name: 6-hydroxy-5,8-dioxo-7-(2-oxopropyl)-7-nonacosanolate IUPAC Name: 6-hydroxy-5,8-dioxo-7-(2-oxopropyl)nonacosan-7-olate Traditional Name: 7-acetonyl-6-hydroxy-5,8-diketo-nonacosan-7-olate Formula: C32H59O5- MolecularWeight: 523.80786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)C)(C(C(=O)CCCC)O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)C)(C(C(=O)CCCC)O)[O-]

InChI

InChI=1S/C32H59O5/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-30(35)32(37,27-28(3)33)31(36)29(34)25-7-5-2/h31,36H,4-27H2,1-3H3/q-1