6-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)hexanoic acid

Systemtic Name: 6-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)hexanoic acid Openeye Name: 6-(3-hydroxy-4-propanoyl-2-propyl-phenoxy)hexanoic acid CAS Name: 6-[3-hydroxy-4-(1-oxopropyl)-2-propylphenoxy]hexanoic acid IUPAC Name: 6-(3-hydroxy-4-propanoyl-2-propylphenoxy)hexanoic acid Traditional Name: 6-(3-hydroxy-4-propionyl-2-propyl-phenoxy)hexanoic acid Formula: C18H26O5 MolecularWeight: 322.39604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCCCC(=O)O

InChI

InChI=1S/C18H26O5/c1-3-8-14-16(23-12-7-5-6-9-17(20)21)11-10-13(18(14)22)15(19)4-2/h10-11,22H,3-9,12H2,1-2H3,(H,20,21)