4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[2-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butyramide Formula: C16H17F3N4O3 MolecularWeight: 370.32639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC=CC=C2C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC=CC=C2C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17F3N4O3/c1-10-15(23(25)26)11(2)22(21-10)9-5-8-14(24)20-13-7-4-3-6-12(13)16(17,18)19/h3-4,6-7H,5,8-9H2,1-2H3,(H,20,24)