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

Systemtic Name: 2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide Openeye Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-methoxy-2-nitro-phenyl)propanamide CAS Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(4-methoxy-2-nitrophenyl)propanamide IUPAC Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-methoxy-2-nitrophenyl)propanamide Traditional Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-methoxy-2-nitro-phenyl)propionamide Formula: C15H14BrF3N4O4 MolecularWeight: 451.19527

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C(F)(F)F)Br

InChI

InChI=1S/C15H14BrF3N4O4/c1-7-12(16)13(15(17,18)19)21-22(7)8(2)14(24)20-10-5-4-9(27-3)6-11(10)23(25)26/h4-6,8H,1-3H3,(H,20,24)