N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-4-bromanyl-6-(trifluoromethyl)-1H-benzimidazol-2-amine

Systemtic Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-4-bromanyl-6-(trifluoromethyl)-1H-benzimidazol-2-amine Openeye Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-amine CAS Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-amine IUPAC Name: N-[4-(1,3-benzodioxol-5-yloxy)phenyl]-4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-amine Traditional Name: [4-(1,3-benzodioxol-5-yloxy)phenyl]-[4-bromo-6-(trifluoromethyl)-1H-benzimidazol-2-yl]amine Formula: C21H13BrF3N3O3 MolecularWeight: 492.24543

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC3=CC=C(C=C3)NC4=NC5=C(N4)C=C(C=C5Br)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC3=CC=C(C=C3)NC4=NC5=C(N4)C=C(C=C5Br)C(F)(F)F

InChI

InChI=1S/C21H13BrF3N3O3/c22-15-7-11(21(23,24)25)8-16-19(15)28-20(27-16)26-12-1-3-13(4-2-12)31-14-5-6-17-18(9-14)30-10-29-17/h1-9H,10H2,(H2,26,27,28)