6-oxidanyl-5,8-bis(oxidanylidene)-7-(2-oxidanylidenebutyl)heptacosan-7-olate

Systemtic Name: 6-oxidanyl-5,8-bis(oxidanylidene)-7-(2-oxidanylidenebutyl)heptacosan-7-olate Openeye Name: 6-hydroxy-5,8-dioxo-7-(2-oxobutyl)heptacosan-7-olate CAS Name: 6-hydroxy-5,8-dioxo-7-(2-oxobutyl)-7-heptacosanolate IUPAC Name: 6-hydroxy-5,8-dioxo-7-(2-oxobutyl)heptacosan-7-olate Traditional Name: 6-hydroxy-5,8-diketo-7-(2-ketobutyl)heptacosan-7-olate Formula: C31H57O5- MolecularWeight: 509.78128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H57O5/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-29(34)31(36,26-27(32)6-3)30(35)28(33)24-8-5-2/h30,35H,4-26H2,1-3H3/q-1