ethyl 3-[4-(trifluoromethyl)phenyl]prop-2-ynoate

Systemtic Name: ethyl 3-[4-(trifluoromethyl)phenyl]prop-2-ynoate Openeye Name: ethyl 3-[4-(trifluoromethyl)phenyl]prop-2-ynoate CAS Name: 3-[4-(trifluoromethyl)phenyl]-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-[4-(trifluoromethyl)phenyl]prop-2-ynoate Traditional Name: 3-[4-(trifluoromethyl)phenyl]propiolic acid ethyl ester Formula: C12H9F3O2 MolecularWeight: 242.19387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC1=CC=C(C=C1)C(F)(F)F

Isomeric SMILES

CCOC(=O)C#CC1=CC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C12H9F3O2/c1-2-17-11(16)8-5-9-3-6-10(7-4-9)12(13,14)15/h3-4,6-7H,2H2,1H3