3-(4-chloranyl-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: 3-(4-chloro-3-nitrophenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Formula: C18H12ClF3N4O3 MolecularWeight: 424.76109

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(F)(F)F)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(F)(F)F)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C18H12ClF3N4O3/c1-9-15(17(23)27)16(10-2-7-13(19)14(8-10)26(28)29)24-25(9)12-5-3-11(4-6-12)18(20,21)22/h2-8H,1H3,(H2,23,27)