[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C14H19N2O3+ MolecularWeight: 263.31226

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C14H18N2O3/c1-15-6-8-16(9-7-15)14(17)13-10-18-11-4-2-3-5-12(11)19-13/h2-5,13H,6-10H2,1H3/p+1/t13-/m1/s1