2-[3-(1,3-benzodioxol-5-yloxy)propanoylamino]ethylazanium

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yloxy)propanoylamino]ethylazanium Openeye Name: 2-[3-(1,3-benzodioxol-5-yloxy)propanoylamino]ethylammonium CAS Name: 2-[[3-(1,3-benzodioxol-5-yloxy)-1-oxopropyl]amino]ethylammonium IUPAC Name: 2-[3-(1,3-benzodioxol-5-yloxy)propanoylamino]ethylazanium Traditional Name: 2-[3-(1,3-benzodioxol-5-yloxy)propanoylamino]ethylammonium Formula: C12H17N2O4+ MolecularWeight: 253.27438

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCC(=O)NCC[NH3+]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCC(=O)NCC[NH3+]

InChI

InChI=1S/C12H16N2O4/c13-4-5-14-12(15)3-6-16-9-1-2-10-11(7-9)18-8-17-10/h1-2,7H,3-6,8,13H2,(H,14,15)/p+1