ethyl 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butanoate

Systemtic Name: ethyl 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butanoate Openeye Name: ethyl 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butanoate CAS Name: 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butanoate Traditional Name: 4-cyano-2-phenyl-3-[4-(trifluoromethyl)phenyl]butyric acid ethyl ester Formula: C20H18F3NO2 MolecularWeight: 361.35763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)C(CC#N)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)C(CC#N)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C20H18F3NO2/c1-2-26-19(25)18(15-6-4-3-5-7-15)17(12-13-24)14-8-10-16(11-9-14)20(21,22)23/h3-11,17-18H,2,12H2,1H3