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

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethyl)-3-(phenylmethyl)-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-(2-amino-2-oxo-ethyl)-3-benzyl-oxadiazol-3-ium-5-olate CAS Name: 4-(2-amino-2-oxoethyl)-3-(phenylmethyl)-5-oxadiazol-3-iumolate IUPAC Name: 4-(2-amino-2-oxoethyl)-3-benzyloxadiazol-3-ium-5-olate Traditional Name: 4-(2-amino-2-keto-ethyl)-3-benzyl-oxadiazol-3-ium-5-olate Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=NOC(=C2CC(=O)N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=NOC(=C2CC(=O)N)[O-]

InChI

InChI=1S/C11H11N3O3/c12-10(15)6-9-11(16)17-13-14(9)7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2-,12,13,15,16)