1-[6-(2-pyridin-2-ylcarbonylimidazol-1-yl)pyridazin-3-yl]piperidine-4-carboxylate

Systemtic Name: 1-[6-(2-pyridin-2-ylcarbonylimidazol-1-yl)pyridazin-3-yl]piperidine-4-carboxylate Openeye Name: 1-[6-[2-(pyridine-2-carbonyl)imidazol-1-yl]pyridazin-3-yl]piperidine-4-carboxylate CAS Name: 1-[6-[2-[oxo(2-pyridinyl)methyl]-1-imidazolyl]-3-pyridazinyl]-4-piperidinecarboxylate IUPAC Name: 1-[6-[2-(pyridine-2-carbonyl)imidazol-1-yl]pyridazin-3-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(2-picolinoylimidazol-1-yl)pyridazin-3-yl]isonipecotate Formula: C19H17N6O3- MolecularWeight: 377.37668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=NN=C(C=C2)N3C=CN=C3C(=O)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=NN=C(C=C2)N3C=CN=C3C(=O)C4=CC=CC=N4

InChI

InChI=1S/C19H18N6O3/c26-17(14-3-1-2-8-20-14)18-21-9-12-25(18)16-5-4-15(22-23-16)24-10-6-13(7-11-24)19(27)28/h1-5,8-9,12-13H,6-7,10-11H2,(H,27,28)/p-1