4-[[[3,6-bis(chloranyl)pyridazin-4-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[3,6-bis(chloranyl)pyridazin-4-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(3,6-dichloropyridazine-4-carbonyl)amino]methyl]benzoic acid CAS Name: 4-[[[(3,6-dichloro-4-pyridazinyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(3,6-dichloropyridazine-4-carbonyl)amino]methyl]benzoic acid Traditional Name: 4-[[(3,6-dichloropyridazine-4-carbonyl)amino]methyl]benzoic acid Formula: C13H9Cl2N3O3 MolecularWeight: 326.13486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=NN=C2Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=NN=C2Cl)Cl)C(=O)O

InChI

InChI=1S/C13H9Cl2N3O3/c14-10-5-9(11(15)18-17-10)12(19)16-6-7-1-3-8(4-2-7)13(20)21/h1-5H,6H2,(H,16,19)(H,20,21)