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

Systemtic Name: 3-oxidanyl-2,5-bis(oxidanylidene)-4-(2-oxidanylidenepropyl)tetracosan-4-olate Openeye Name: 4-acetonyl-3-hydroxy-2,5-dioxo-tetracosan-4-olate CAS Name: 3-hydroxy-2,5-dioxo-4-(2-oxopropyl)-4-tetracosanolate IUPAC Name: 3-hydroxy-2,5-dioxo-4-(2-oxopropyl)tetracosan-4-olate Traditional Name: 4-acetonyl-3-hydroxy-2,5-diketo-tetracosan-4-olate Formula: C27H49O5- MolecularWeight: 453.67496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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