ethyl 2-[2-hexanoyl-3,5-bis(oxidanyl)phenyl]ethanoate

Systemtic Name: ethyl 2-[2-hexanoyl-3,5-bis(oxidanyl)phenyl]ethanoate Openeye Name: ethyl 2-(2-hexanoyl-3,5-dihydroxy-phenyl)acetate CAS Name: 2-[3,5-dihydroxy-2-(1-oxohexyl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-hexanoyl-3,5-dihydroxyphenyl)acetate Traditional Name: 2-(2-caproyl-3,5-dihydroxy-phenyl)acetic acid ethyl ester Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(C=C(C=C1CC(=O)OCC)O)O

Isomeric SMILES

CCCCCC(=O)C1=C(C=C(C=C1CC(=O)OCC)O)O

InChI

InChI=1S/C16H22O5/c1-3-5-6-7-13(18)16-11(9-15(20)21-4-2)8-12(17)10-14(16)19/h8,10,17,19H,3-7,9H2,1-2H3