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

Systemtic Name: 4-bromanyl-3-nitro-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-bromo-3-nitro-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide CAS Name: 4-bromo-3-nitro-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-bromo-3-nitro-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-bromo-3-nitro-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzamide Formula: C17H10BrF3N4O3 MolecularWeight: 455.18551

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CN(N=C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C17H10BrF3N4O3/c18-12-4-2-10(8-15(12)25(27)28)16(26)23-13-9-11(17(19,20)21)3-5-14(13)24-7-1-6-22-24/h1-9H,(H,23,26)