2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone chloride

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone chloride Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone chloride CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl(1-piperazin-4-iumyl)methanone chloride IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone chloride Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-4-ium-1-yl)methanone chloride Formula: C13H17ClN2O3 MolecularWeight: 284.73868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2COC3=CC=CC=C3O2.[Cl-]

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2COC3=CC=CC=C3O2.[Cl-]

InChI

InChI=1S/C13H16N2O3.ClH/c16-13(15-7-5-14-6-8-15)12-9-17-10-3-1-2-4-11(10)18-12;/h1-4,12,14H,5-9H2;1H