[4-(trifluoromethyl)phenyl] 4-octylbenzoate

Systemtic Name: [4-(trifluoromethyl)phenyl] 4-octylbenzoate Openeye Name: [4-(trifluoromethyl)phenyl] 4-octylbenzoate CAS Name: 4-octylbenzoic acid [4-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(trifluoromethyl)phenyl] 4-octylbenzoate Traditional Name: 4-octylbenzoic acid [4-(trifluoromethyl)phenyl] ester Formula: C22H25F3O2 MolecularWeight: 378.42791

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C22H25F3O2/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)21(26)27-20-15-13-19(14-16-20)22(23,24)25/h9-16H,2-8H2,1H3