(1E)-N-(3-morpholin-4-yl-1,2,3-oxadiazol-3-ium-5-yl)-1-(4-nitrophenoxy)methanimidate

Systemtic Name: (1E)-N-(3-morpholin-4-yl-1,2,3-oxadiazol-3-ium-5-yl)-1-(4-nitrophenoxy)methanimidate Openeye Name: (1E)-N-(3-morpholinooxadiazol-3-ium-5-yl)-1-(4-nitrophenoxy)methanimidate CAS Name: (1E)-N-[3-(4-morpholinyl)-5-oxadiazol-3-iumyl]-1-(4-nitrophenoxy)methanimidate IUPAC Name: (1E)-N-(3-morpholin-4-yloxadiazol-3-ium-5-yl)-1-(4-nitrophenoxy)methanimidate Traditional Name: (1E)-N-(3-morpholinooxadiazol-3-ium-5-yl)-1-(4-nitrophenoxy)formimidate Formula: C13H13N5O6 MolecularWeight: 335.27222

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1[N+]2=NOC(=C2)N=C([O-])OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1[N+]2=NOC(=C2)/N=C(\[O-])/OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H13N5O6/c19-13(23-11-3-1-10(2-4-11)18(20)21)14-12-9-17(15-24-12)16-5-7-22-8-6-16/h1-4,9H,5-8H2