(1E)-1-methoxy-N-(3-phenethyl-1,2,3-oxadiazol-3-ium-5-yl)methanimidate

Systemtic Name: (1E)-1-methoxy-N-(3-phenethyl-1,2,3-oxadiazol-3-ium-5-yl)methanimidate Openeye Name: (1E)-1-methoxy-N-(3-phenethyloxadiazol-3-ium-5-yl)methanimidate CAS Name: (1E)-1-methoxy-N-(3-phenethyl-5-oxadiazol-3-iumyl)methanimidate IUPAC Name: (1E)-1-methoxy-N-(3-phenethyloxadiazol-3-ium-5-yl)methanimidate Traditional Name: (1E)-1-methoxy-N-(3-phenethyloxadiazol-3-ium-5-yl)formimidate Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NC1=C[N+](=NO1)CCC2=CC=CC=C2)[O-]

Isomeric SMILES

CO/C(=N/C1=C[N+](=NO1)CCC2=CC=CC=C2)/[O-]

InChI

InChI=1S/C12H13N3O3/c1-17-12(16)13-11-9-15(14-18-11)8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3