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

Systemtic Name: 4-ethanoyl-5-oxidanyl-2,6-bis(oxidanylidene)heptacosan-4-olate Openeye Name: 4-acetyl-5-hydroxy-2,6-dioxo-heptacosan-4-olate CAS Name: 4-acetyl-5-hydroxy-2,6-dioxo-4-heptacosanolate IUPAC Name: 4-acetyl-5-hydroxy-2,6-dioxoheptacosan-4-olate Traditional Name: 4-acetyl-5-hydroxy-2,6-diketo-heptacosan-4-olate Formula: C29H53O5- MolecularWeight: 481.72812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H53O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(32)28(33)29(34,26(3)31)24-25(2)30/h28,33H,4-24H2,1-3H3/q-1