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

Systemtic Name: 3-[2-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]ethoxy]benzoic acid Openeye Name: 3-[2-(3,6-dioxo-1H-pyridazin-2-yl)ethoxy]benzoic acid CAS Name: 3-[2-(3,6-dioxo-1H-pyridazin-2-yl)ethoxy]benzoic acid IUPAC Name: 3-[2-(3,6-dioxo-1H-pyridazin-2-yl)ethoxy]benzoic acid Traditional Name: 3-[2-(3,6-diketo-1H-pyridazin-2-yl)ethoxy]benzoic acid Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCN2C(=O)C=CC(=O)N2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCCN2C(=O)C=CC(=O)N2)C(=O)O

InChI

InChI=1S/C13H12N2O5/c16-11-4-5-12(17)15(14-11)6-7-20-10-3-1-2-9(8-10)13(18)19/h1-5,8H,6-7H2,(H,14,16)(H,18,19)