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

Systemtic Name: 4-ethanoyl-5-oxidanyl-2,6-bis(oxidanylidene)pentacosan-4-olate Openeye Name: 4-acetyl-5-hydroxy-2,6-dioxo-pentacosan-4-olate CAS Name: 4-acetyl-5-hydroxy-2,6-dioxo-4-pentacosanolate IUPAC Name: 4-acetyl-5-hydroxy-2,6-dioxopentacosan-4-olate Traditional Name: 4-acetyl-5-hydroxy-2,6-diketo-pentacosan-4-olate Formula: C27H49O5- MolecularWeight: 453.67496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)C(C(CC(=O)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)26(31)27(32,24(3)29)22-23(2)28/h26,31H,4-22H2,1-3H3/q-1