ethyl 4-oxidanidyl-1-phenyl-1,2,4-triazol-4-ium-3-carboxylate

Systemtic Name: ethyl 4-oxidanidyl-1-phenyl-1,2,4-triazol-4-ium-3-carboxylate Openeye Name: ethyl 4-oxido-1-phenyl-1,2,4-triazol-4-ium-3-carboxylate CAS Name: 4-oxido-1-phenyl-1,2,4-triazol-4-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxido-1-phenyl-1,2,4-triazol-4-ium-3-carboxylate Traditional Name: 4-oxido-1-phenyl-1,2,4-triazol-4-ium-3-carboxylic acid ethyl ester Formula: C11H11N3O3 MolecularWeight: 233.22334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=[N+]1[O-])C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NN(C=[N+]1[O-])C2=CC=CC=C2

InChI

InChI=1S/C11H11N3O3/c1-2-17-11(15)10-12-13(8-14(10)16)9-6-4-3-5-7-9/h3-8H,2H2,1H3