3-[(3-oxidanidyl-6-oxidanylidene-pyridazin-1-yl)methyl]benzoate

Systemtic Name: 3-[(3-oxidanidyl-6-oxidanylidene-pyridazin-1-yl)methyl]benzoate Openeye Name: 3-[(3-oxido-6-oxo-pyridazin-1-yl)methyl]benzoate CAS Name: 3-[(3-oxido-6-oxo-1-pyridazinyl)methyl]benzoate IUPAC Name: 3-[(3-oxido-6-oxopyridazin-1-yl)methyl]benzoate Traditional Name: 3-[(6-keto-3-oxido-pyridazin-1-yl)methyl]benzoate Formula: C12H8N2O4-2 MolecularWeight: 244.20292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C(=O)C=CC(=N2)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)CN2C(=O)C=CC(=N2)[O-])C(=O)[O-]

InChI

InChI=1S/C12H10N2O4/c15-10-4-5-11(16)14(13-10)7-8-2-1-3-9(6-8)12(17)18/h1-6H,7H2,(H,13,15)(H,17,18)/p-2