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

Systemtic Name: methyl 3,3,3-tris(fluoranyl)-2-(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-2-oxidanyl-propanoate Openeye Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)propanoate CAS Name: 3,3,3-trifluoro-2-hydroxy-2-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)propanoic acid methyl ester IUPAC Name: methyl 3,3,3-trifluoro-2-hydroxy-2-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)propanoate Traditional Name: 3,3,3-trifluoro-2-hydroxy-2-(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)propionic acid methyl ester Formula: C14H13F3N2O4 MolecularWeight: 330.25923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C(=O)OC)(C(F)(F)F)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C(=O)OC)(C(F)(F)F)O

InChI

InChI=1S/C14H13F3N2O4/c1-8-10(13(22,12(21)23-2)14(15,16)17)11(20)19(18-8)9-6-4-3-5-7-9/h3-7,18,22H,1-2H3