ethyl 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]ethanoate

Systemtic Name: ethyl 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]ethanoate Openeye Name: ethyl 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]acetate CAS Name: 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]acetate Traditional Name: 2-cyano-2,2-bis[4-(trifluoromethyl)phenyl]acetic acid ethyl ester Formula: C19H13F6NO2 MolecularWeight: 401.302439

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13F6NO2/c1-2-28-16(27)17(11-26,12-3-7-14(8-4-12)18(20,21)22)13-5-9-15(10-6-13)19(23,24)25/h3-10H,2H2,1H3