[2-(5-ethoxypentoxycarbonyl)phenyl] 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoate

Systemtic Name: [2-(5-ethoxypentoxycarbonyl)phenyl] 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoate Openeye Name: [2-(5-ethoxypentoxycarbonyl)phenyl] 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoate CAS Name: 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoic acid [2-[5-ethoxypentoxy(oxo)methyl]phenyl] ester IUPAC Name: [2-(5-ethoxypentoxycarbonyl)phenyl] 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoate Traditional Name: 4-(4-nonoxyphenyl)-3-(trifluoromethyl)benzoic acid [2-(5-ethoxypentoxycarbonyl)phenyl] ester Formula: C37H45F3O6 MolecularWeight: 642.74481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OCCCCCOCC)C(F)(F)F

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3C(=O)OCCCCCOCC)C(F)(F)F

InChI

InChI=1S/C37H45F3O6/c1-3-5-6-7-8-9-14-25-44-30-21-18-28(19-22-30)31-23-20-29(27-33(31)37(38,39)40)35(41)46-34-17-12-11-16-32(34)36(42)45-26-15-10-13-24-43-4-2/h11-12,16-23,27H,3-10,13-15,24-26H2,1-2H3