3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-chloranyl-5-nitro-phenyl)propanamide

Systemtic Name: 3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-chloranyl-5-nitro-phenyl)propanamide Openeye Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-chloro-5-nitro-phenyl)propanamide CAS Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(2-chloro-5-nitrophenyl)propanamide IUPAC Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-chloro-5-nitrophenyl)propanamide Traditional Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-chloro-5-nitro-phenyl)propionamide Formula: C14H11BrClF3N4O3 MolecularWeight: 455.61435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C(F)(F)F)Br

InChI

InChI=1S/C14H11BrClF3N4O3/c1-7-12(15)13(14(17,18)19)21-22(7)5-4-11(24)20-10-6-8(23(25)26)2-3-9(10)16/h2-3,6H,4-5H2,1H3,(H,20,24)