3-oxidanyl-2,5-bis(oxidanylidene)-4-(2-oxidanylidenepropyl)icosan-4-olate

Systemtic Name: 3-oxidanyl-2,5-bis(oxidanylidene)-4-(2-oxidanylidenepropyl)icosan-4-olate Openeye Name: 4-acetonyl-3-hydroxy-2,5-dioxo-icosan-4-olate CAS Name: 3-hydroxy-2,5-dioxo-4-(2-oxopropyl)-4-eicosanolate IUPAC Name: 3-hydroxy-2,5-dioxo-4-(2-oxopropyl)icosan-4-olate Traditional Name: 4-acetonyl-3-hydroxy-2,5-diketo-eicosan-4-olate Formula: C23H41O5- MolecularWeight: 397.56864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H41O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(26)23(28,18-19(2)24)22(27)20(3)25/h22,27H,4-18H2,1-3H3/q-1