2-ethoxyethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate

Systemtic Name: 2-ethoxyethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate Openeye Name: 2-ethoxyethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate CAS Name: 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate Traditional Name: 1-oxidobenzofurazan-1-ium-5-carboxylic acid 2-ethoxyethyl ester Formula: C11H12N2O5 MolecularWeight: 252.22338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1=CC2=NO[N+](=C2C=C1)[O-]

Isomeric SMILES

CCOCCOC(=O)C1=CC2=NO[N+](=C2C=C1)[O-]

InChI

InChI=1S/C11H12N2O5/c1-2-16-5-6-17-11(14)8-3-4-10-9(7-8)12-18-13(10)15/h3-4,7H,2,5-6H2,1H3