methyl 3-[2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]benzoate CAS Name: 3-[[2-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]benzoate Traditional Name: 3-[[2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C17H16F3N3O3 MolecularWeight: 367.32245

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=CC(=N2)C(F)(F)F)C3CC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CN2C(=CC(=N2)C(F)(F)F)C3CC3

InChI

InChI=1S/C17H16F3N3O3/c1-26-16(25)11-3-2-4-12(7-11)21-15(24)9-23-13(10-5-6-10)8-14(22-23)17(18,19)20/h2-4,7-8,10H,5-6,9H2,1H3,(H,21,24)