methyl 4-[[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]amino]butanoate CAS Name: 4-[[[5-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]amino]butanoate Traditional Name: 4-[[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carbonyl]amino]butyric acid methyl ester Formula: C17H18F3N3O3 MolecularWeight: 369.33833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCCC(=O)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C17H18F3N3O3/c1-11-14(16(25)21-8-4-7-15(24)26-2)10-22-23(11)13-6-3-5-12(9-13)17(18,19)20/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,21,25)