ethyl 6-methoxy-7-methyl-3-oxidanidyl-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8-carboxylate

Systemtic Name: ethyl 6-methoxy-7-methyl-3-oxidanidyl-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8-carboxylate Openeye Name: ethyl 6-methoxy-7-methyl-3-oxido-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8-carboxylate CAS Name: 6-methoxy-7-methyl-3-oxido-8-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 6-methoxy-7-methyl-3-oxidopyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8-carboxylate Traditional Name: 6-methoxy-7-methyl-3-oxido-pyrrolo[2,3-g][2,1,3]benzoxadiazol-3-ium-8-carboxylic acid ethyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C3=NO[N+](=C3C=C2)[O-])OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C3=NO[N+](=C3C=C2)[O-])OC)C

InChI

InChI=1S/C13H13N3O5/c1-4-20-13(17)10-7(2)15(19-3)8-5-6-9-12(11(8)10)14-21-16(9)18/h5-6H,4H2,1-3H3