[4-(4-pentoxyphenyl)phenyl] 3-fluoranyl-4-octoxy-benzoate

Systemtic Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoranyl-4-octoxy-benzoate Openeye Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-octoxy-benzoate CAS Name: 3-fluoro-4-octoxybenzoic acid [4-(4-pentoxyphenyl)phenyl] ester IUPAC Name: [4-(4-pentoxyphenyl)phenyl] 3-fluoro-4-octoxybenzoate Traditional Name: 3-fluoro-4-octoxy-benzoic acid [4-(4-amoxyphenyl)phenyl] ester Formula: C32H39FO4 MolecularWeight: 506.648063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCC)F

InChI

InChI=1S/C32H39FO4/c1-3-5-7-8-9-11-23-36-31-21-16-27(24-30(31)33)32(34)37-29-19-14-26(15-20-29)25-12-17-28(18-13-25)35-22-10-6-4-2/h12-21,24H,3-11,22-23H2,1-2H3