1-[(3R)-5-(4-methylphenyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[(3R)-5-(4-methylphenyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-4-phenyl-butan-1-one Openeye Name: 1-[(3R)-3-hydroxy-5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-2-yl]-4-phenyl-butan-1-one CAS Name: 1-[(3R)-3-hydroxy-5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-2-yl]-4-phenyl-1-butanone IUPAC Name: 1-[(3R)-3-hydroxy-5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-2-yl]-4-phenylbutan-1-one Traditional Name: 1-[(5R)-5-hydroxy-3-(p-tolyl)-5-(trifluoromethyl)-3-pyrazolin-1-yl]-4-phenyl-butan-1-one Formula: C21H21F3N2O2 MolecularWeight: 390.39885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(N(N2)C(=O)CCCC3=CC=CC=C3)(C(F)(F)F)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=C[C@](N(N2)C(=O)CCCC3=CC=CC=C3)(C(F)(F)F)O

InChI

InChI=1S/C21H21F3N2O2/c1-15-10-12-17(13-11-15)18-14-20(28,21(22,23)24)26(25-18)19(27)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-14,25,28H,5,8-9H2,1H3/t20-/m1/s1