17-oxidanyl-16,19-bis(oxidanylidene)-18-(2-oxidanylidenepentyl)tetracontan-18-olate

Systemtic Name: 17-oxidanyl-16,19-bis(oxidanylidene)-18-(2-oxidanylidenepentyl)tetracontan-18-olate Openeye Name: 17-hydroxy-16,19-dioxo-18-(2-oxopentyl)tetracontan-18-olate CAS Name: 17-hydroxy-16,19-dioxo-18-(2-oxopentyl)-18-tetracontanolate IUPAC Name: 17-hydroxy-16,19-dioxo-18-(2-oxopentyl)tetracontan-18-olate Traditional Name: 17-hydroxy-16,19-diketo-18-(2-ketopentyl)tetracontan-18-olate Formula: C45H85O5- MolecularWeight: 706.1534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C45H85O5/c1-4-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-39-43(48)45(50,40-41(46)37-6-3)44(49)42(47)38-35-33-31-29-27-25-18-16-14-12-10-8-5-2/h44,49H,4-40H2,1-3H3/q-1