4-[[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]carbonyl]benzamide

Systemtic Name: 4-[[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]carbonyl]benzamide Openeye Name: 4-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazole-1-carbonyl]benzamide CAS Name: 4-[[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-oxomethyl]benzamide IUPAC Name: 4-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazole-1-carbonyl]benzamide Traditional Name: 4-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazoline-1-carbonyl]benzamide Formula: C13H12F3N3O3 MolecularWeight: 315.24789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC1=NN([C@@](C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C13H12F3N3O3/c1-7-6-12(22,13(14,15)16)19(18-7)11(21)9-4-2-8(3-5-9)10(17)20/h2-5,22H,6H2,1H3,(H2,17,20)/t12-/m1/s1