5-oxidanyl-4,7-bis(oxidanylidene)-6-(2-oxidanylidenepropyl)tetracosan-6-olate

Systemtic Name: 5-oxidanyl-4,7-bis(oxidanylidene)-6-(2-oxidanylidenepropyl)tetracosan-6-olate Openeye Name: 6-acetonyl-5-hydroxy-4,7-dioxo-tetracosan-6-olate CAS Name: 5-hydroxy-4,7-dioxo-6-(2-oxopropyl)-6-tetracosanolate IUPAC Name: 5-hydroxy-4,7-dioxo-6-(2-oxopropyl)tetracosan-6-olate Traditional Name: 6-acetonyl-5-hydroxy-4,7-diketo-tetracosan-6-olate Formula: C27H49O5- MolecularWeight: 453.67496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H49O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25(30)27(32,22-23(3)28)26(31)24(29)20-5-2/h26,31H,4-22H2,1-3H3/q-1