(4-pentan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluoranyl-phenyl)benzoate

Systemtic Name: (4-pentan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluoranyl-phenyl)benzoate Openeye Name: [4-(1-methylbutoxy)phenyl] 2-(4-decanoyloxy-2-fluoro-phenyl)benzoate CAS Name: 2-[2-fluoro-4-(1-oxodecoxy)phenyl]benzoic acid (4-pentan-2-yloxyphenyl) ester IUPAC Name: (4-pentan-2-yloxyphenyl) 2-(4-decanoyloxy-2-fluorophenyl)benzoate Traditional Name: 2-(4-capryloxy-2-fluoro-phenyl)benzoic acid [4-(1-methylbutoxy)phenyl] ester Formula: C34H41FO5 MolecularWeight: 548.684743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCC)F

Isomeric SMILES

CCCCCCCCCC(=O)OC1=CC(=C(C=C1)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)OC(C)CCC)F

InChI

InChI=1S/C34H41FO5/c1-4-6-7-8-9-10-11-17-33(36)39-28-22-23-30(32(35)24-28)29-15-12-13-16-31(29)34(37)40-27-20-18-26(19-21-27)38-25(3)14-5-2/h12-13,15-16,18-25H,4-11,14,17H2,1-3H3