4-[[(6-chloranylpyridazin-3-yl)amino]methyl]benzoate

Systemtic Name: 4-[[(6-chloranylpyridazin-3-yl)amino]methyl]benzoate Openeye Name: 4-[[(6-chloropyridazin-3-yl)amino]methyl]benzoate CAS Name: 4-[[(6-chloro-3-pyridazinyl)amino]methyl]benzoate IUPAC Name: 4-[[(6-chloropyridazin-3-yl)amino]methyl]benzoate Traditional Name: 4-[[(6-chloropyridazin-3-yl)amino]methyl]benzoate Formula: C12H9ClN3O2- MolecularWeight: 262.67176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NN=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC2=NN=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C12H10ClN3O2/c13-10-5-6-11(16-15-10)14-7-8-1-3-9(4-2-8)12(17)18/h1-6H,7H2,(H,14,16)(H,17,18)/p-1