(1-azanyl-1-oxidanylidene-propan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate CAS Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylate Traditional Name: 4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxylic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C15H14F3N3O4 MolecularWeight: 357.28457

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=NN(C=C1OC)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=NN(C=C1OC)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C15H14F3N3O4/c1-8(13(19)22)25-14(23)12-11(24-2)7-21(20-12)10-5-3-4-9(6-10)15(16,17)18/h3-8H,1-2H3,(H2,19,22)