2-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carbonyl]amino]ethyl-diethyl-ammonium Formula: C16H21N4O4+ MolecularWeight: 333.36234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=NC(=NO1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=NC(=NO1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N4O4/c1-3-20(4-2)8-7-17-15(21)16-18-14(19-24-16)11-5-6-12-13(9-11)23-10-22-12/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,17,21)/p+1