4-oxidanyl-3,6-bis(oxidanylidene)-5-(2-oxidanylidenepropyl)pentacosan-5-olate

Systemtic Name: 4-oxidanyl-3,6-bis(oxidanylidene)-5-(2-oxidanylidenepropyl)pentacosan-5-olate Openeye Name: 5-acetonyl-4-hydroxy-3,6-dioxo-pentacosan-5-olate CAS Name: 4-hydroxy-3,6-dioxo-5-(2-oxopropyl)-5-pentacosanolate IUPAC Name: 4-hydroxy-3,6-dioxo-5-(2-oxopropyl)pentacosan-5-olate Traditional Name: 5-acetonyl-4-hydroxy-3,6-diketo-pentacosan-5-olate Formula: C28H51O5- MolecularWeight: 467.70154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)C)(C(C(=O)CC)O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)C(CC(=O)C)(C(C(=O)CC)O)[O-]

InChI

InChI=1S/C28H51O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26(31)28(33,23-24(3)29)27(32)25(30)5-2/h27,32H,4-23H2,1-3H3/q-1