4-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]methyl]benzoic acid

Systemtic Name: 4-[[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]methyl]benzoic acid Openeye Name: 4-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]benzoic acid CAS Name: 4-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]benzoic acid IUPAC Name: 4-[(3,6-dioxo-1H-pyridazin-2-yl)methyl]benzoic acid Traditional Name: 4-[(3,6-diketo-1H-pyridazin-2-yl)methyl]benzoic acid Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=O)C=CC(=O)N2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CN2C(=O)C=CC(=O)N2)C(=O)O

InChI

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