N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-morpholin-4-ium-4-yl-acetamide Formula: C13H15F2N2O4+ MolecularWeight: 301.266006

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

C1COCC[NH+]1CC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C13H14F2N2O4/c14-13(15)20-10-2-1-9(7-11(10)21-13)16-12(18)8-17-3-5-19-6-4-17/h1-2,7H,3-6,8H2,(H,16,18)/p+1