3-[(3R)-3-(4-fluorophenyl)-5-methyl-3-oxidanyl-1H-pyrazol-2-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[(3R)-3-(4-fluorophenyl)-5-methyl-3-oxidanyl-1H-pyrazol-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[(3R)-3-(4-fluorophenyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]-3-oxo-propanenitrile CAS Name: 3-[(3R)-3-(4-fluorophenyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]-3-oxopropanenitrile IUPAC Name: 3-[(3R)-3-(4-fluorophenyl)-3-hydroxy-5-methyl-1H-pyrazol-2-yl]-3-oxopropanenitrile Traditional Name: 3-[(5R)-5-(4-fluorophenyl)-5-hydroxy-3-methyl-3-pyrazolin-1-yl]-3-keto-propionitrile Formula: C13H12FN3O2 MolecularWeight: 261.251683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(N(N1)C(=O)CC#N)(C2=CC=C(C=C2)F)O

Isomeric SMILES

CC1=C[C@](N(N1)C(=O)CC#N)(C2=CC=C(C=C2)F)O

InChI

InChI=1S/C13H12FN3O2/c1-9-8-13(19,10-2-4-11(14)5-3-10)17(16-9)12(18)6-7-15/h2-5,8,16,19H,6H2,1H3/t13-/m1/s1