N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-4-ium-1-sulfonamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-4-ium-1-sulfonamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-4-ium-1-sulfonamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazin-4-iumsulfonamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-4-ium-1-sulfonamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-4-ium-1-sulfonamide Formula: C12H18N3O4S+ MolecularWeight: 300.35402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C12H17N3O4S/c16-20(17,15-5-3-13-4-6-15)14-10-1-2-11-12(9-10)19-8-7-18-11/h1-2,9,13-14H,3-8H2/p+1