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

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]piperazin-4-ium-1-sulfonamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)piperazin-4-ium-1-sulfonamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)piperazin-4-ium-1-sulfonamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)piperazin-4-ium-1-sulfonamide Formula: C11H14F2N3O4S+ MolecularWeight: 322.308366

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)NC2=CC3=C(C=C2)OC(O3)(F)F

InChI

InChI=1S/C11H13F2N3O4S/c12-11(13)19-9-2-1-8(7-10(9)20-11)15-21(17,18)16-5-3-14-4-6-16/h1-2,7,14-15H,3-6H2/p+1