1-[(5S)-5-oxidanyl-5-(4-pentylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[(5S)-5-oxidanyl-5-(4-pentylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[(5S)-5-hydroxy-5-(4-pentylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[(5S)-5-hydroxy-5-(4-pentylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenylethanone IUPAC Name: 1-[(5S)-5-hydroxy-5-(4-pentylphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenylethanone Traditional Name: 1-[(5S)-5-(4-amylphenyl)-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-2-phenyl-ethanone Formula: C23H25F3N2O2 MolecularWeight: 418.45201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2(CC(=NN2C(=O)CC3=CC=CC=C3)C(F)(F)F)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)[C@]2(CC(=NN2C(=O)CC3=CC=CC=C3)C(F)(F)F)O

InChI

InChI=1S/C23H25F3N2O2/c1-2-3-5-8-17-11-13-19(14-12-17)22(30)16-20(23(24,25)26)27-28(22)21(29)15-18-9-6-4-7-10-18/h4,6-7,9-14,30H,2-3,5,8,15-16H2,1H3/t22-/m0/s1