[4-(4-decoxy-3-fluoranyl-phenyl)-2-fluoranyl-phenyl] 3-pentylcyclobutane-1-carboxylate

Systemtic Name: [4-(4-decoxy-3-fluoranyl-phenyl)-2-fluoranyl-phenyl] 3-pentylcyclobutane-1-carboxylate Openeye Name: [4-(4-decoxy-3-fluoro-phenyl)-2-fluoro-phenyl] 3-pentylcyclobutanecarboxylate CAS Name: 3-pentyl-1-cyclobutanecarboxylic acid [4-(4-decoxy-3-fluorophenyl)-2-fluorophenyl] ester IUPAC Name: [4-(4-decoxy-3-fluorophenyl)-2-fluorophenyl] 3-pentylcyclobutane-1-carboxylate Traditional Name: 3-amylcyclobutanecarboxylic acid [4-(4-decoxy-3-fluoro-phenyl)-2-fluoro-phenyl] ester Formula: C32H44F2O3 MolecularWeight: 514.686766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3CC(C3)CCCCC)F)F

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3CC(C3)CCCCC)F)F

InChI

InChI=1S/C32H44F2O3/c1-3-5-7-8-9-10-11-13-19-36-30-17-15-25(22-28(30)33)26-16-18-31(29(34)23-26)37-32(35)27-20-24(21-27)14-12-6-4-2/h15-18,22-24,27H,3-14,19-21H2,1-2H3