6-[[4-(trifluoromethyloxy)phenyl]methylcarbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[4-(trifluoromethyloxy)phenyl]methylcarbamoyl]pyridazin-3-olate Openeye Name: 6-[[4-(trifluoromethoxy)phenyl]methylcarbamoyl]pyridazin-3-olate CAS Name: 6-[oxo-[[4-(trifluoromethoxy)phenyl]methylamino]methyl]-3-pyridazinolate IUPAC Name: 6-[[4-(trifluoromethoxy)phenyl]methylcarbamoyl]pyridazin-3-olate Traditional Name: 6-[[4-(trifluoromethoxy)benzyl]carbamoyl]pyridazin-3-olate Formula: C13H9F3N3O3- MolecularWeight: 312.22407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=NN=C(C=C2)[O-])OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=NN=C(C=C2)[O-])OC(F)(F)F

InChI

InChI=1S/C13H10F3N3O3/c14-13(15,16)22-9-3-1-8(2-4-9)7-17-12(21)10-5-6-11(20)19-18-10/h1-6H,7H2,(H,17,21)(H,19,20)/p-1