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

Systemtic Name: methyl 2-(5-azanyl-3-methyl-1-phenyl-pyrazol-4-yl)-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate Openeye Name: methyl 2-(5-amino-3-methyl-1-phenyl-pyrazol-4-yl)-3,3,3-trifluoro-2-hydroxy-propanoate CAS Name: 2-(5-amino-3-methyl-1-phenyl-4-pyrazolyl)-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-(5-amino-3-methyl-1-phenylpyrazol-4-yl)-3,3,3-trifluoro-2-hydroxypropanoate Traditional Name: 2-(5-amino-3-methyl-1-phenyl-pyrazol-4-yl)-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Formula: C14H14F3N3O3 MolecularWeight: 329.27447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(C(=O)OC)(C(F)(F)F)O)N)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(C(=O)OC)(C(F)(F)F)O)N)C2=CC=CC=C2

InChI

InChI=1S/C14H14F3N3O3/c1-8-10(13(22,12(21)23-2)14(15,16)17)11(18)20(19-8)9-6-4-3-5-7-9/h3-7,22H,18H2,1-2H3