2-(4-hexanoyl-3-oxidanyl-phenoxy)ethanoic acid

Systemtic Name: 2-(4-hexanoyl-3-oxidanyl-phenoxy)ethanoic acid Openeye Name: 2-(4-hexanoyl-3-hydroxy-phenoxy)acetic acid CAS Name: 2-[3-hydroxy-4-(1-oxohexyl)phenoxy]acetic acid IUPAC Name: 2-(4-hexanoyl-3-hydroxyphenoxy)acetic acid Traditional Name: 2-(4-caproyl-3-hydroxy-phenoxy)acetic acid Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O5/c1-2-3-4-5-12(15)11-7-6-10(8-13(11)16)19-9-14(17)18/h6-8,16H,2-5,9H2,1H3,(H,17,18)