4-[4-(4-hexylphenyl)phenoxy]butanoic acid

Systemtic Name: 4-[4-(4-hexylphenyl)phenoxy]butanoic acid Openeye Name: 4-[4-(4-hexylphenyl)phenoxy]butanoic acid CAS Name: 4-[4-(4-hexylphenyl)phenoxy]butanoic acid IUPAC Name: 4-[4-(4-hexylphenyl)phenoxy]butanoic acid Traditional Name: 4-[4-(4-hexylphenyl)phenoxy]butyric acid Formula: C22H28O3 MolecularWeight: 340.45592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCC(=O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCCCC(=O)O

InChI

InChI=1S/C22H28O3/c1-2-3-4-5-7-18-9-11-19(12-10-18)20-13-15-21(16-14-20)25-17-6-8-22(23)24/h9-16H,2-8,17H2,1H3,(H,23,24)