5-(1,3-benzodioxol-5-yl)-1-(4-bromanyl-2-fluoranyl-phenyl)-1,2,4-triazole

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-(4-bromanyl-2-fluoranyl-phenyl)-1,2,4-triazole Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-(4-bromo-2-fluoro-phenyl)-1,2,4-triazole CAS Name: 5-(1,3-benzodioxol-5-yl)-1-(4-bromo-2-fluorophenyl)-1,2,4-triazole IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-(4-bromo-2-fluorophenyl)-1,2,4-triazole Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-(4-bromo-2-fluoro-phenyl)-1,2,4-triazole Formula: C15H9BrFN3O2 MolecularWeight: 362.153263

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC=NN3C4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC=NN3C4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C15H9BrFN3O2/c16-10-2-3-12(11(17)6-10)20-15(18-7-19-20)9-1-4-13-14(5-9)22-8-21-13/h1-7H,8H2