N-(4-fluoranyl-3-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide CAS Name: N-(4-fluoro-3-nitrophenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-1,5-diphenyl-1,2,4-triazole-3-carboxamide Formula: C21H14FN5O3 MolecularWeight: 403.365963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C21H14FN5O3/c22-17-12-11-15(13-18(17)27(29)30)23-21(28)19-24-20(14-7-3-1-4-8-14)26(25-19)16-9-5-2-6-10-16/h1-13H,(H,23,28)