3-(4-bromanylpyrazol-1-yl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide

Systemtic Name: 3-(4-bromanylpyrazol-1-yl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide Openeye Name: 3-(4-bromopyrazol-1-yl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide CAS Name: 3-(4-bromo-1-pyrazolyl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide IUPAC Name: 3-(4-bromopyrazol-1-yl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propanamide Traditional Name: 3-(4-bromopyrazol-1-yl)-2-methyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]propionamide Formula: C20H16BrF3N4O4 MolecularWeight: 513.26465

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(CN1C=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H16BrF3N4O4/c1-12(10-27-11-14(21)9-25-27)19(29)26-15-6-16(28(30)31)8-18(7-15)32-17-4-2-3-13(5-17)20(22,23)24/h2-9,11-12H,10H2,1H3,(H,26,29)