N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-1,3-diphenyl-pyrazole-4-carboxamide Formula: C22H14Br2N4O3 MolecularWeight: 542.17956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=C(C=C(C=C3Br)[N+](=O)[O-])Br)C4=CC=CC=C4

InChI

InChI=1S/C22H14Br2N4O3/c23-18-11-16(28(30)31)12-19(24)21(18)25-22(29)17-13-27(15-9-5-2-6-10-15)26-20(17)14-7-3-1-4-8-14/h1-13H,(H,25,29)