2-[2-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-keto-ethoxy]benzonitrile Formula: C14H12F3N3O3 MolecularWeight: 327.25859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC=CC=C2C#N

Isomeric SMILES

CC1=NN([C@](C1)(C(F)(F)F)O)C(=O)COC2=CC=CC=C2C#N

InChI

InChI=1S/C14H12F3N3O3/c1-9-6-13(22,14(15,16)17)20(19-9)12(21)8-23-11-5-3-2-4-10(11)7-18/h2-5,22H,6,8H2,1H3/t13-/m0/s1