tert-butyl 2-[[4-cyano-3-(trifluoromethyl)phenyl]-(cyclopropylmethyl)amino]ethanoate

Systemtic Name: tert-butyl 2-[[4-cyano-3-(trifluoromethyl)phenyl]-(cyclopropylmethyl)amino]ethanoate Openeye Name: tert-butyl 2-[4-cyano-N-(cyclopropylmethyl)-3-(trifluoromethyl)anilino]acetate CAS Name: 2-[4-cyano-N-(cyclopropylmethyl)-3-(trifluoromethyl)anilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-cyano-N-(cyclopropylmethyl)-3-(trifluoromethyl)anilino]acetate Traditional Name: 2-[4-cyano-N-(cyclopropylmethyl)-3-(trifluoromethyl)anilino]acetic acid tert-butyl ester Formula: C18H21F3N2O2 MolecularWeight: 354.36675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(CC1CC1)C2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)CN(CC1CC1)C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C18H21F3N2O2/c1-17(2,3)25-16(24)11-23(10-12-4-5-12)14-7-6-13(9-22)15(8-14)18(19,20)21/h6-8,12H,4-5,10-11H2,1-3H3