tert-butyl (3S)-3-azanyl-4-oxidanylidene-5-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-pentanoate

Systemtic Name: tert-butyl (3S)-3-azanyl-4-oxidanylidene-5-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-pentanoate Openeye Name: tert-butyl (3S)-3-amino-4-oxo-5-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-pentanoate CAS Name: (3S)-3-amino-4-oxo-5-[[2-phenyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-amino-4-oxo-5-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]oxypentanoate Traditional Name: (3S)-3-amino-4-keto-5-[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-valeric acid tert-butyl ester Formula: C19H22F3N3O4 MolecularWeight: 413.39089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)COC1=CC(=NN1C2=CC=CC=C2)C(F)(F)F)N

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](C(=O)COC1=CC(=NN1C2=CC=CC=C2)C(F)(F)F)N

InChI

InChI=1S/C19H22F3N3O4/c1-18(2,3)29-17(27)9-13(23)14(26)11-28-16-10-15(19(20,21)22)24-25(16)12-7-5-4-6-8-12/h4-8,10,13H,9,11,23H2,1-3H3/t13-/m0/s1