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

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Formula: C18H12ClF3N4O4 MolecularWeight: 440.76049

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NNC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NNC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H12ClF3N4O4/c1-9-4-12(2-3-14(9)19)30-13-6-10(5-11(7-13)26(28)29)23-17(27)15-8-16(25-24-15)18(20,21)22/h2-8H,1H3,(H,23,27)(H,24,25)