pentadecan-2-yl 4-(trifluoromethyl)benzoate

Systemtic Name: pentadecan-2-yl 4-(trifluoromethyl)benzoate Openeye Name: 1-methyltetradecyl 4-(trifluoromethyl)benzoate CAS Name: 4-(trifluoromethyl)benzoic acid pentadecan-2-yl ester IUPAC Name: pentadecan-2-yl 4-(trifluoromethyl)benzoate Traditional Name: 4-(trifluoromethyl)benzoic acid 1-methyltetradecyl ester Formula: C23H35F3O2 MolecularWeight: 400.51801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C)OC(=O)C1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCCCCC(C)OC(=O)C1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C23H35F3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-19(2)28-22(27)20-15-17-21(18-16-20)23(24,25)26/h15-19H,3-14H2,1-2H3