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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-yl(piperazin-4-ium-1-yl)methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-yl(piperazin-4-ium-1-yl)methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-6-yl(1-piperazin-4-iumyl)methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-yl(piperazin-4-ium-1-yl)methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl(piperazin-4-ium-1-yl)methanone Formula: C13H17N2O3+ MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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