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

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]ethanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]acetamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]acetamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]acetamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]acetamide Formula: C18H12BrF3N4O4 MolecularWeight: 485.21149

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)Br)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=C(C=N3)Br)C(F)(F)F

InChI

InChI=1S/C18H12BrF3N4O4/c19-12-8-23-25(9-12)10-17(27)24-13-5-14(26(28)29)7-16(6-13)30-15-3-1-2-11(4-15)18(20,21)22/h1-9H,10H2,(H,24,27)