N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-1-[(2-chloranyl-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-1-[(2-chloro-4-nitrophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2-chloro-4-nitrophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-1-[(2-chloro-4-nitro-phenoxy)methyl]pyrazole-3-carboxamide Formula: C21H16BrClN6O4 MolecularWeight: 531.74654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)CN4C=C(C=N4)Br

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)CN4C=C(C=N4)Br

InChI

InChI=1S/C21H16BrClN6O4/c22-15-10-24-28(12-15)11-14-2-1-3-16(8-14)25-21(30)19-6-7-27(26-19)13-33-20-5-4-17(29(31)32)9-18(20)23/h1-10,12H,11,13H2,(H,25,30)