3-[4-(2-ethanoyl-6-oxidanyl-undecyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(2-ethanoyl-6-oxidanyl-undecyl)phenyl]propanoic acid Openeye Name: 3-[4-(2-acetyl-6-hydroxy-undecyl)phenyl]propanoic acid CAS Name: 3-[4-(2-acetyl-6-hydroxyundecyl)phenyl]propanoic acid IUPAC Name: 3-[4-(2-acetyl-6-hydroxyundecyl)phenyl]propanoic acid Traditional Name: 3-[4-(2-acetyl-6-hydroxy-undecyl)phenyl]propionic acid Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CC1=CC=C(C=C1)CCC(=O)O)C(=O)C)O

Isomeric SMILES

CCCCCC(CCCC(CC1=CC=C(C=C1)CCC(=O)O)C(=O)C)O

InChI

InChI=1S/C22H34O4/c1-3-4-5-8-21(24)9-6-7-20(17(2)23)16-19-12-10-18(11-13-19)14-15-22(25)26/h10-13,20-21,24H,3-9,14-16H2,1-2H3,(H,25,26)