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

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide Formula: C15H18F2N3O4+ MolecularWeight: 342.317926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C15H17F2N3O4/c1-10(21)20-6-4-19(5-7-20)9-14(22)18-11-2-3-12-13(8-11)24-15(16,17)23-12/h2-3,8H,4-7,9H2,1H3,(H,18,22)/p+1