8-[(4-methoxyphenyl)-[3-(trifluoromethyl)phenyl]carbonyl-amino]octanoic acid

Systemtic Name: 8-[(4-methoxyphenyl)-[3-(trifluoromethyl)phenyl]carbonyl-amino]octanoic acid Openeye Name: 8-(4-methoxy-N-[3-(trifluoromethyl)benzoyl]anilino)octanoic acid CAS Name: 8-(4-methoxy-N-[oxo-[3-(trifluoromethyl)phenyl]methyl]anilino)octanoic acid IUPAC Name: 8-(4-methoxy-N-[3-(trifluoromethyl)benzoyl]anilino)octanoic acid Traditional Name: 8-(4-methoxy-N-[3-(trifluoromethyl)benzoyl]anilino)caprylic acid Formula: C23H26F3NO4 MolecularWeight: 437.45205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCCCCCCC(=O)O)C(=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)N(CCCCCCCC(=O)O)C(=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C23H26F3NO4/c1-31-20-13-11-19(12-14-20)27(15-6-4-2-3-5-10-21(28)29)22(30)17-8-7-9-18(16-17)23(24,25)26/h7-9,11-14,16H,2-6,10,15H2,1H3,(H,28,29)