4-(3-fluoranyl-4-tetradecoxy-phenyl)benzoic acid

Systemtic Name: 4-(3-fluoranyl-4-tetradecoxy-phenyl)benzoic acid Openeye Name: 4-(3-fluoro-4-tetradecoxy-phenyl)benzoic acid CAS Name: 4-(3-fluoro-4-tetradecoxyphenyl)benzoic acid IUPAC Name: 4-(3-fluoro-4-tetradecoxyphenyl)benzoic acid Traditional Name: 4-(3-fluoro-4-myristyloxy-phenyl)benzoic acid Formula: C27H37FO3 MolecularWeight: 428.579283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C27H37FO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-31-26-19-18-24(21-25(26)28)22-14-16-23(17-15-22)27(29)30/h14-19,21H,2-13,20H2,1H3,(H,29,30)