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

Systemtic Name: N-(4-chloranyl-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Openeye Name: N-(4-chloro-3-nitro-phenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide CAS Name: N-(4-chloro-3-nitrophenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: N-(4-chloro-3-nitrophenyl)-5-methyl-1-[4-(trifluoromethyl)phenyl]pyrazole-4-carboxamide Traditional Name: N-(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)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

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