6-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydro-1,4-benzodioxin-7-amine

Systemtic Name: 6-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydro-1,4-benzodioxin-7-amine Openeye Name: 6-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydro-1,4-benzodioxin-7-amine CAS Name: 6-(4-methyl-1-piperazin-4-iumyl)-2,3-dihydro-1,4-benzodioxin-7-amine IUPAC Name: 6-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydro-1,4-benzodioxin-7-amine Traditional Name: [6-(4-methylpiperazin-4-ium-1-yl)-2,3-dihydro-1,4-benzodioxin-7-yl]amine Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC3=C(C=C2N)OCCO3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC3=C(C=C2N)OCCO3

InChI

InChI=1S/C13H19N3O2/c1-15-2-4-16(5-3-15)11-9-13-12(8-10(11)14)17-6-7-18-13/h8-9H,2-7,14H2,1H3/p+1