butyl 4-[4-(trifluoromethyl)phenyl]benzoate

Systemtic Name: butyl 4-[4-(trifluoromethyl)phenyl]benzoate Openeye Name: butyl 4-[4-(trifluoromethyl)phenyl]benzoate CAS Name: 4-[4-(trifluoromethyl)phenyl]benzoic acid butyl ester IUPAC Name: butyl 4-[4-(trifluoromethyl)phenyl]benzoate Traditional Name: 4-[4-(trifluoromethyl)phenyl]benzoic acid butyl ester Formula: C18H17F3O2 MolecularWeight: 322.32159

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C18H17F3O2/c1-2-3-12-23-17(22)15-6-4-13(5-7-15)14-8-10-16(11-9-14)18(19,20)21/h4-11H,2-3,12H2,1H3