4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(trifluoromethyloxy)phenyl]butanamide

Systemtic Name: 4-(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(trifluoromethyloxy)phenyl]butanamide Openeye Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide CAS Name: 4-(4-chloro-5-methyl-3-nitro-1-pyrazolyl)-N-[4-(trifluoromethoxy)phenyl]butanamide IUPAC Name: 4-(4-chloro-5-methyl-3-nitropyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butanamide Traditional Name: 4-(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)-N-[4-(trifluoromethoxy)phenyl]butyramide Formula: C15H14ClF3N4O4 MolecularWeight: 406.74427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC=C(C=C2)OC(F)(F)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H14ClF3N4O4/c1-9-13(16)14(23(25)26)21-22(9)8-2-3-12(24)20-10-4-6-11(7-5-10)27-15(17,18)19/h4-7H,2-3,8H2,1H3,(H,20,24)