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

Systemtic Name: 2-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]carbamoyl]benzoate Openeye Name: 2-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]carbamoyl]benzoate CAS Name: 2-[oxo-[[1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]amino]methyl]benzoate IUPAC Name: 2-[[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]carbamoyl]benzoate Traditional Name: 2-[[1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]carbamoyl]benzoate Formula: C19H13F3N3O3- MolecularWeight: 388.32003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C19H14F3N3O3/c20-19(21,22)13-5-3-4-12(8-13)10-25-11-14(9-23-25)24-17(26)15-6-1-2-7-16(15)18(27)28/h1-9,11H,10H2,(H,24,26)(H,27,28)/p-1