5-[(4-fluoranylphenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole

Systemtic Name: 5-[(4-fluoranylphenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole Openeye Name: 5-[(4-fluorophenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole CAS Name: 5-[(4-fluorophenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole IUPAC Name: 5-[(4-fluorophenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole Traditional Name: 5-[(4-fluorophenoxy)methyl]-3-(3-nitrophenyl)-1H-1,2,4-triazole Formula: C15H11FN4O3 MolecularWeight: 314.271243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NNC(=N2)COC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=NNC(=N2)COC3=CC=C(C=C3)F

InChI

InChI=1S/C15H11FN4O3/c16-11-4-6-13(7-5-11)23-9-14-17-15(19-18-14)10-2-1-3-12(8-10)20(21)22/h1-8H,9H2,(H,17,18,19)