2-[2-octanoyl-3,5-bis(oxidanyl)phenyl]ethanoic acid

Systemtic Name: 2-[2-octanoyl-3,5-bis(oxidanyl)phenyl]ethanoic acid Openeye Name: 2-(3,5-dihydroxy-2-octanoyl-phenyl)acetic acid CAS Name: 2-[3,5-dihydroxy-2-(1-oxooctyl)phenyl]acetic acid IUPAC Name: 2-(3,5-dihydroxy-2-octanoylphenyl)acetic acid Traditional Name: 2-(2-caprylyl-3,5-dihydroxy-phenyl)acetic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(C=C(C=C1CC(=O)O)O)O

Isomeric SMILES

CCCCCCCC(=O)C1=C(C=C(C=C1CC(=O)O)O)O

InChI

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