[2,6-diethyl-4-methanoyl-3-(5-oxidanylidenepentanoyloxy)phenyl] 5-oxidanylidenepentanoate

Systemtic Name: [2,6-diethyl-4-methanoyl-3-(5-oxidanylidenepentanoyloxy)phenyl] 5-oxidanylidenepentanoate Openeye Name: [2,6-diethyl-4-formyl-3-(5-oxopentanoyloxy)phenyl] 5-oxopentanoate CAS Name: 5-oxopentanoic acid [3-(1,5-dioxopentoxy)-2,6-diethyl-4-formylphenyl] ester IUPAC Name: [2,6-diethyl-4-formyl-3-(5-oxopentanoyloxy)phenyl] 5-oxopentanoate Traditional Name: 5-ketovaleric acid [2,6-diethyl-4-formyl-3-(5-ketopentanoyloxy)phenyl] ester Formula: C21H26O7 MolecularWeight: 390.42694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C=O)OC(=O)CCCC=O)CC)OC(=O)CCCC=O

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C=O)OC(=O)CCCC=O)CC)OC(=O)CCCC=O

InChI

InChI=1S/C21H26O7/c1-3-15-13-16(14-24)21(28-19(26)10-6-8-12-23)17(4-2)20(15)27-18(25)9-5-7-11-22/h11-14H,3-10H2,1-2H3