(4R)-2-(4-fluorophenyl)-4-[[(2S)-2-oxidanyl-2-phenyl-ethyl]iminomethyl]-5-propyl-4H-pyrazol-3-one

Systemtic Name: (4R)-2-(4-fluorophenyl)-4-[[(2S)-2-oxidanyl-2-phenyl-ethyl]iminomethyl]-5-propyl-4H-pyrazol-3-one Openeye Name: (4R)-2-(4-fluorophenyl)-4-[[(2S)-2-hydroxy-2-phenyl-ethyl]iminomethyl]-5-propyl-4H-pyrazol-3-one CAS Name: (4R)-2-(4-fluorophenyl)-4-[[(2S)-2-hydroxy-2-phenylethyl]iminomethyl]-5-propyl-4H-pyrazol-3-one IUPAC Name: (4R)-2-(4-fluorophenyl)-4-[[(2S)-2-hydroxy-2-phenylethyl]iminomethyl]-5-propyl-4H-pyrazol-3-one Traditional Name: (4R)-2-(4-fluorophenyl)-4-[[(2S)-2-hydroxy-2-phenyl-ethyl]iminomethyl]-5-propyl-2-pyrazolin-3-one Formula: C21H22FN3O2 MolecularWeight: 367.416683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1C=NCC(C2=CC=CC=C2)O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCC1=NN(C(=O)[C@@H]1C=NC[C@H](C2=CC=CC=C2)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O2/c1-2-6-19-18(13-23-14-20(26)15-7-4-3-5-8-15)21(27)25(24-19)17-11-9-16(22)10-12-17/h3-5,7-13,18,20,26H,2,6,14H2,1H3/t18-,20-/m1/s1