N-[3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[2-(4-bromanyl-2-fluoranyl-phenoxy)ethanoylamino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[[2-(4-bromo-2-fluorophenoxy)-1-oxoethyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[[2-(4-bromo-2-fluorophenoxy)acetyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-[[2-(4-bromo-2-fluoro-phenoxy)acetyl]amino]phenyl]-piperonylamide Formula: C22H16BrFN2O5 MolecularWeight: 487.275243

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)COC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)COC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C22H16BrFN2O5/c23-14-5-7-18(17(24)9-14)29-11-21(27)25-15-2-1-3-16(10-15)26-22(28)13-4-6-19-20(8-13)31-12-30-19/h1-10H,11-12H2,(H,25,27)(H,26,28)