4-oxidanylidene-4-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]amino]butanoate Openeye Name: 4-oxo-4-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]butanoate CAS Name: 4-oxo-4-[4-[3-(trifluoromethyl)-1-pyrazolyl]anilino]butanoate IUPAC Name: 4-oxo-4-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]butanoate Traditional Name: 4-keto-4-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]butyrate Formula: C14H11F3N3O3- MolecularWeight: 326.25065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCC(=O)[O-])N2C=CC(=N2)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCC(=O)[O-])N2C=CC(=N2)C(F)(F)F

InChI

InChI=1S/C14H12F3N3O3/c15-14(16,17)11-7-8-20(19-11)10-3-1-9(2-4-10)18-12(21)5-6-13(22)23/h1-4,7-8H,5-6H2,(H,18,21)(H,22,23)/p-1