methyl 3,3,3-tris(fluoranyl)-2-oxidanyl-2-(3-oxidanylidene-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)propanoate

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-oxidanyl-2-(3-oxidanylidene-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)propanoate Openeye Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(5-isopropyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)propanoate CAS Name: 3,3,3-trifluoro-2-hydroxy-2-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(3-oxo-2-phenyl-5-propan-2-yl-1H-pyrazol-4-yl)propanoate Traditional Name: 3,3,3-trifluoro-2-hydroxy-2-(3-isopropyl-5-keto-1-phenyl-3-pyrazolin-4-yl)propionic acid methyl ester Formula: C16H17F3N2O4 MolecularWeight: 358.31239

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C(=O)OC)(C(F)(F)F)O

Isomeric SMILES

CC(C)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C(=O)OC)(C(F)(F)F)O

InChI

InChI=1S/C16H17F3N2O4/c1-9(2)12-11(15(24,14(23)25-3)16(17,18)19)13(22)21(20-12)10-7-5-4-6-8-10/h4-9,20,24H,1-3H3