N-[2-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-cyano-pyrazol-3-yl]-4-oxidanylidene-pentanamide

Systemtic Name: N-[2-[2-chloranyl-4-(trifluoromethyl)phenyl]-4-cyano-pyrazol-3-yl]-4-oxidanylidene-pentanamide Openeye Name: N-[2-[2-chloro-4-(trifluoromethyl)phenyl]-4-cyano-pyrazol-3-yl]-4-oxo-pentanamide CAS Name: N-[2-[2-chloro-4-(trifluoromethyl)phenyl]-4-cyano-3-pyrazolyl]-4-oxopentanamide IUPAC Name: N-[2-[2-chloro-4-(trifluoromethyl)phenyl]-4-cyanopyrazol-3-yl]-4-oxopentanamide Traditional Name: N-[2-[2-chloro-4-(trifluoromethyl)phenyl]-4-cyano-pyrazol-3-yl]-4-keto-valeramide Formula: C16H12ClF3N4O2 MolecularWeight: 384.74029

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)NC1=C(C=NN1C2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

Isomeric SMILES

CC(=O)CCC(=O)NC1=C(C=NN1C2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C16H12ClF3N4O2/c1-9(25)2-5-14(26)23-15-10(7-21)8-22-24(15)13-4-3-11(6-12(13)17)16(18,19)20/h3-4,6,8H,2,5H2,1H3,(H,23,26)