4-oxidanyl-3,6-bis(oxidanylidene)-5-(2-oxidanylidenebutyl)henicosan-5-olate

Systemtic Name: 4-oxidanyl-3,6-bis(oxidanylidene)-5-(2-oxidanylidenebutyl)henicosan-5-olate Openeye Name: 4-hydroxy-3,6-dioxo-5-(2-oxobutyl)henicosan-5-olate CAS Name: 4-hydroxy-3,6-dioxo-5-(2-oxobutyl)-5-heneicosanolate IUPAC Name: 4-hydroxy-3,6-dioxo-5-(2-oxobutyl)henicosan-5-olate Traditional Name: 4-hydroxy-3,6-diketo-5-(2-ketobutyl)heneicosan-5-olate Formula: C25H45O5- MolecularWeight: 425.6218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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