N'-(2-methylhexanoyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbohydrazide

Systemtic Name: N'-(2-methylhexanoyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbohydrazide Openeye Name: N'-(2-methylhexanoyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbohydrazide CAS Name: N'-(2-methyl-1-oxohexyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolecarbohydrazide IUPAC Name: N'-(2-methylhexanoyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbohydrazide Traditional Name: N'-(2-methylhexanoyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbohydrazide Formula: C18H20F3N5O4 MolecularWeight: 427.37771

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(=O)NNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CCCCC(C)C(=O)NNC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H20F3N5O4/c1-3-4-5-11(2)16(27)23-24-17(28)14-10-22-25(15(14)18(19,20)21)12-6-8-13(9-7-12)26(29)30/h6-11H,3-5H2,1-2H3,(H,23,27)(H,24,28)