11-oxidanyl-10,14-bis(oxidanylidene)-12-(2-propylpentanoyl)tricosan-12-olate

Systemtic Name: 11-oxidanyl-10,14-bis(oxidanylidene)-12-(2-propylpentanoyl)tricosan-12-olate Openeye Name: 11-hydroxy-10,14-dioxo-12-(2-propylpentanoyl)tricosan-12-olate CAS Name: 11-hydroxy-10,14-dioxo-12-(1-oxo-2-propylpentyl)-12-tricosanolate IUPAC Name: 11-hydroxy-10,14-dioxo-12-(2-propylpentanoyl)tricosan-12-olate Traditional Name: 11-hydroxy-10,14-diketo-12-(2-propylpentanoyl)tricosan-12-olate Formula: C31H57O5- MolecularWeight: 509.78128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCC)O)(C(=O)C(CCC)CCC)[O-]

Isomeric SMILES

CCCCCCCCCC(=O)CC(C(C(=O)CCCCCCCCC)O)(C(=O)C(CCC)CCC)[O-]

InChI

InChI=1S/C31H57O5/c1-5-9-11-13-15-17-19-23-27(32)25-31(36,29(34)26(21-7-3)22-8-4)30(35)28(33)24-20-18-16-14-12-10-6-2/h26,30,35H,5-25H2,1-4H3/q-1