N-(3-piperidin-1-ium-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-(3-piperidin-1-ium-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-(3-piperidin-1-ium-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[3-(1-piperidin-1-iumyl)propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-(3-piperidin-1-ium-1-ylpropyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-(3-piperidin-1-ium-1-ylpropyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C16H25N2O4S+ MolecularWeight: 341.4457

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H24N2O4S/c19-23(20,17-7-4-10-18-8-2-1-3-9-18)14-5-6-15-16(13-14)22-12-11-21-15/h5-6,13,17H,1-4,7-12H2/p+1