4-(2-methoxy-2-oxidanylidene-ethyl)-3-(phenylmethyl)-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-(2-methoxy-2-oxidanylidene-ethyl)-3-(phenylmethyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-benzyl-4-(2-methoxy-2-oxo-ethyl)oxadiazol-3-ium-5-olate CAS Name: 4-(2-methoxy-2-oxoethyl)-3-(phenylmethyl)-5-oxadiazol-3-iumolate IUPAC Name: 3-benzyl-4-(2-methoxy-2-oxoethyl)oxadiazol-3-ium-5-olate Traditional Name: 3-benzyl-4-(2-keto-2-methoxy-ethyl)oxadiazol-3-ium-5-olate Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(ON=[N+]1CC2=CC=CC=C2)[O-]

Isomeric SMILES

COC(=O)CC1=C(ON=[N+]1CC2=CC=CC=C2)[O-]

InChI

InChI=1S/C12H12N2O4/c1-17-11(15)7-10-12(16)18-13-14(10)8-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3