pentyl 2-chloranyl-4-(trifluoromethyl)benzoate

Systemtic Name: pentyl 2-chloranyl-4-(trifluoromethyl)benzoate Openeye Name: pentyl 2-chloro-4-(trifluoromethyl)benzoate CAS Name: 2-chloro-4-(trifluoromethyl)benzoic acid pentyl ester IUPAC Name: pentyl 2-chloro-4-(trifluoromethyl)benzoate Traditional Name: 2-chloro-4-(trifluoromethyl)benzoic acid amyl ester Formula: C13H14ClF3O2 MolecularWeight: 294.69727

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C=C(C=C1)C(F)(F)F)Cl

Isomeric SMILES

CCCCCOC(=O)C1=C(C=C(C=C1)C(F)(F)F)Cl

InChI

InChI=1S/C13H14ClF3O2/c1-2-3-4-7-19-12(18)10-6-5-9(8-11(10)14)13(15,16)17/h5-6,8H,2-4,7H2,1H3