[3-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-propan-2-yloxycarbonyl-1,2,3-triazol-4-yl]methyl-diethyl-azanium

Systemtic Name: [3-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-propan-2-yloxycarbonyl-1,2,3-triazol-4-yl]methyl-diethyl-azanium Openeye Name: [3-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropoxycarbonyl-triazol-4-yl]methyl-diethyl-ammonium CAS Name: [3-(4-amino-1,2,5-oxadiazol-3-yl)-5-[oxo(propan-2-yloxy)methyl]-4-triazolyl]methyl-diethylammonium IUPAC Name: [3-(4-amino-1,2,5-oxadiazol-3-yl)-5-propan-2-yloxycarbonyltriazol-4-yl]methyl-diethylazanium Traditional Name: [3-(4-aminofurazan-3-yl)-5-isopropoxycarbonyl-triazol-4-yl]methyl-diethyl-ammonium Formula: C13H22N7O3+ MolecularWeight: 324.35888

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(N=NN1C2=NON=C2N)C(=O)OC(C)C

Isomeric SMILES

CC[NH+](CC)CC1=C(N=NN1C2=NON=C2N)C(=O)OC(C)C

InChI

InChI=1S/C13H21N7O3/c1-5-19(6-2)7-9-10(13(21)22-8(3)4)15-18-20(9)12-11(14)16-23-17-12/h8H,5-7H2,1-4H3,(H2,14,16)/p+1