4-diazonio-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-2H-pyrrol-5-olate

Systemtic Name: 4-diazonio-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-2H-pyrrol-5-olate Openeye Name: 4-diazonio-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2H-pyrrol-5-olate CAS Name: 4-diazonio-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2H-pyrrol-5-olate IUPAC Name: 4-diazonio-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2H-pyrrol-5-olate Traditional Name: 3-diazonio-4-keto-1-veratryl-2-pyrrolin-2-olate Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CC(=O)C(=C2[O-])[N+]#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC(=O)C(=C2[O-])[N+]#N)OC

InChI

InChI=1S/C13H13N3O4/c1-19-10-4-3-8(5-11(10)20-2)6-16-7-9(17)12(15-14)13(16)18/h3-5H,6-7H2,1-2H3