N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-yl-pyridin-1-ium-3-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-yl-pyridin-1-ium-3-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-morpholino-pyridin-1-ium-3-sulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-(4-morpholinyl)-3-pyridin-1-iumsulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-morpholin-4-ylpyridin-1-ium-3-sulfonamide Traditional Name: 6-morpholino-N-piperonyl-pyridin-1-ium-3-sulfonamide Formula: C17H20N3O5S+ MolecularWeight: 378.4228

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19N3O5S/c21-26(22,19-10-13-1-3-15-16(9-13)25-12-24-15)14-2-4-17(18-11-14)20-5-7-23-8-6-20/h1-4,9,11,19H,5-8,10,12H2/p+1