2-(4-octadecoxyphenyl)butanoic acid

Systemtic Name: 2-(4-octadecoxyphenyl)butanoic acid Openeye Name: 2-(4-octadecoxyphenyl)butanoic acid CAS Name: 2-(4-octadecoxyphenyl)butanoic acid IUPAC Name: 2-(4-octadecoxyphenyl)butanoic acid Traditional Name: 2-(4-stearyloxyphenyl)butyric acid Formula: C28H48O3 MolecularWeight: 432.67892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(CC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(CC)C(=O)O

InChI

InChI=1S/C28H48O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-31-26-22-20-25(21-23-26)27(4-2)28(29)30/h20-23,27H,3-19,24H2,1-2H3,(H,29,30)