3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl-methyl-amino]propylazanium

Systemtic Name: 3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonyl-methyl-amino]propylazanium Openeye Name: 3-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]-methyl-amino]propylammonium CAS Name: 3-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]-methylamino]propylammonium IUPAC Name: 3-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]-methylamino]propylazanium Traditional Name: 3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]-methyl-amino]propylammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC[NH3+])C(=O)C1COC2=CC=CC=C2O1

Isomeric SMILES

CN(CCC[NH3+])C(=O)[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C13H18N2O3/c1-15(8-4-7-14)13(16)12-9-17-10-5-2-3-6-11(10)18-12/h2-3,5-6,12H,4,7-9,14H2,1H3/p+1/t12-/m1/s1