4-oxidanyl-3,7-bis(oxidanylidene)-5-propanoyl-docosan-5-olate

Systemtic Name: 4-oxidanyl-3,7-bis(oxidanylidene)-5-propanoyl-docosan-5-olate Openeye Name: 4-hydroxy-3,7-dioxo-5-propanoyl-docosan-5-olate CAS Name: 4-hydroxy-3,7-dioxo-5-(1-oxopropyl)-5-docosanolate IUPAC Name: 4-hydroxy-3,7-dioxo-5-propanoyldocosan-5-olate Traditional Name: 4-hydroxy-3,7-diketo-5-propionyl-docosan-5-olate Formula: C25H45O5- MolecularWeight: 425.6218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H45O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-21(26)20-25(30,23(28)6-3)24(29)22(27)5-2/h24,29H,4-20H2,1-3H3/q-1