3-[2-(3-oxidanidyl-6-oxidanylidene-pyridazin-1-yl)ethanoylamino]benzoate

Systemtic Name: 3-[2-(3-oxidanidyl-6-oxidanylidene-pyridazin-1-yl)ethanoylamino]benzoate Openeye Name: 3-[[2-(3-oxido-6-oxo-pyridazin-1-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(3-oxido-6-oxo-1-pyridazinyl)-1-oxoethyl]amino]benzoate IUPAC Name: 3-[[2-(3-oxido-6-oxopyridazin-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(6-keto-3-oxido-pyridazin-1-yl)acetyl]amino]benzoate Formula: C13H9N3O5-2 MolecularWeight: 287.22766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O5/c17-10-4-5-12(19)16(15-10)7-11(18)14-9-3-1-2-8(6-9)13(20)21/h1-6H,7H2,(H,14,18)(H,15,17)(H,20,21)/p-2