8-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-propyl-octanoic acid

Systemtic Name: 8-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-propyl-octanoic acid Openeye Name: 8-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-propyl-octanoic acid CAS Name: 8-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-propyloctanoic acid IUPAC Name: 8-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-propyloctanoic acid Traditional Name: 8-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-propyl-caprylic acid Formula: C22H34O5 MolecularWeight: 378.50236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCC(CCC)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCC(CCC)C(=O)O

InChI

InChI=1S/C22H34O5/c1-4-10-17(22(25)26)12-8-6-7-9-15-27-20-14-13-18(16(3)23)21(24)19(20)11-5-2/h13-14,17,24H,4-12,15H2,1-3H3,(H,25,26)