5-oxidanylidene-5-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]amino]pentanoate

Systemtic Name: 5-oxidanylidene-5-[[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]amino]pentanoate Openeye Name: 5-oxo-5-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]pentanoate CAS Name: 5-oxo-5-[4-[3-(trifluoromethyl)-1-pyrazolyl]anilino]pentanoate IUPAC Name: 5-oxo-5-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]pentanoate Traditional Name: 5-keto-5-[4-[3-(trifluoromethyl)pyrazol-1-yl]anilino]valerate Formula: C15H13F3N3O3- MolecularWeight: 340.27723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14F3N3O3/c16-15(17,18)12-8-9-21(20-12)11-6-4-10(5-7-11)19-13(22)2-1-3-14(23)24/h4-9H,1-3H2,(H,19,22)(H,23,24)/p-1