methyl 4-[[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-[3-(trifluoromethyl)-1-pyrazolyl]ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]methyl]benzoic acid methyl ester Formula: C15H14F3N3O3 MolecularWeight: 341.28517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C=CC(=N2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C=CC(=N2)C(F)(F)F

InChI

InChI=1S/C15H14F3N3O3/c1-24-14(23)11-4-2-10(3-5-11)8-19-13(22)9-21-7-6-12(20-21)15(16,17)18/h2-7H,8-9H2,1H3,(H,19,22)