2-morpholin-4-ylethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate

Systemtic Name: 2-morpholin-4-ylethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate Openeye Name: 2-morpholinoethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate CAS Name: 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate Traditional Name: 1-oxidobenzofurazan-1-ium-5-carboxylic acid 2-morpholinoethyl ester Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC(=O)C2=CC3=NO[N+](=C3C=C2)[O-]

Isomeric SMILES

C1COCCN1CCOC(=O)C2=CC3=NO[N+](=C3C=C2)[O-]

InChI

InChI=1S/C13H15N3O5/c17-13(20-8-5-15-3-6-19-7-4-15)10-1-2-12-11(9-10)14-21-16(12)18/h1-2,9H,3-8H2