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

Systemtic Name: 6-oxidanyl-5,8-bis(oxidanylidene)-7-(2-oxidanylidenepropyl)pentacosan-7-olate Openeye Name: 7-acetonyl-6-hydroxy-5,8-dioxo-pentacosan-7-olate CAS Name: 6-hydroxy-5,8-dioxo-7-(2-oxopropyl)-7-pentacosanolate IUPAC Name: 6-hydroxy-5,8-dioxo-7-(2-oxopropyl)pentacosan-7-olate Traditional Name: 7-acetonyl-6-hydroxy-5,8-diketo-pentacosan-7-olate Formula: C28H51O5- MolecularWeight: 467.70154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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