N-[1-(furan-2-ylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[1-(furan-2-ylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[1-(2-furylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[1-(2-furanylmethyl)-5-(trifluoromethyl)-2-benzimidazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[1-(furan-2-ylmethyl)-5-(trifluoromethyl)benzimidazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[1-(2-furfuryl)-5-(trifluoromethyl)benzimidazol-2-yl]-piperonylamide Formula: C21H14F3N3O4 MolecularWeight: 429.34877

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC4=C(N3CC5=CC=CO5)C=CC(=C4)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC4=C(N3CC5=CC=CO5)C=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H14F3N3O4/c22-21(23,24)13-4-5-16-15(9-13)25-20(27(16)10-14-2-1-7-29-14)26-19(28)12-3-6-17-18(8-12)31-11-30-17/h1-9H,10-11H2,(H,25,26,28)