[4-(trifluoromethyl)phenyl] 4-heptylbenzoate

Systemtic Name: [4-(trifluoromethyl)phenyl] 4-heptylbenzoate Openeye Name: [4-(trifluoromethyl)phenyl] 4-heptylbenzoate CAS Name: 4-heptylbenzoic acid [4-(trifluoromethyl)phenyl] ester IUPAC Name: [4-(trifluoromethyl)phenyl] 4-heptylbenzoate Traditional Name: 4-heptylbenzoic acid [4-(trifluoromethyl)phenyl] ester Formula: C21H23F3O2 MolecularWeight: 364.40133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C21H23F3O2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)20(25)26-19-14-12-18(13-15-19)21(22,23)24/h8-15H,2-7H2,1H3