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

Systemtic Name: 1-[6-(2-pyridin-3-ylcarbonylimidazol-1-yl)pyridazin-3-yl]piperidine-4-carboxylic acid Openeye Name: 1-[6-[2-(pyridine-3-carbonyl)imidazol-1-yl]pyridazin-3-yl]piperidine-4-carboxylic acid CAS Name: 1-[6-[2-[oxo(3-pyridinyl)methyl]-1-imidazolyl]-3-pyridazinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[6-[2-(pyridine-3-carbonyl)imidazol-1-yl]pyridazin-3-yl]piperidine-4-carboxylic acid Traditional Name: 1-[6-(2-nicotinoylimidazol-1-yl)pyridazin-3-yl]isonipecotic acid Formula: C19H18N6O3 MolecularWeight: 378.38462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=NN=C(C=C2)N3C=CN=C3C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=NN=C(C=C2)N3C=CN=C3C(=O)C4=CN=CC=C4

InChI

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