2-(3-octadecoxyphenyl)ethanoic acid

Systemtic Name: 2-(3-octadecoxyphenyl)ethanoic acid Openeye Name: 2-(3-octadecoxyphenyl)acetic acid CAS Name: 2-(3-octadecoxyphenyl)acetic acid IUPAC Name: 2-(3-octadecoxyphenyl)acetic acid Traditional Name: 2-(3-stearyloxyphenyl)acetic acid Formula: C26H44O3 MolecularWeight: 404.62576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H44O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-29-25-20-18-19-24(22-25)23-26(27)28/h18-20,22H,2-17,21,23H2,1H3,(H,27,28)