1-(5-chloranyl-1-ethyl-6-oxidanylidene-pyridazin-4-yl)piperidine-4-carboxylate

Systemtic Name: 1-(5-chloranyl-1-ethyl-6-oxidanylidene-pyridazin-4-yl)piperidine-4-carboxylate Openeye Name: 1-(5-chloro-1-ethyl-6-oxo-pyridazin-4-yl)piperidine-4-carboxylate CAS Name: 1-(5-chloro-1-ethyl-6-oxo-4-pyridazinyl)-4-piperidinecarboxylate IUPAC Name: 1-(5-chloro-1-ethyl-6-oxopyridazin-4-yl)piperidine-4-carboxylate Traditional Name: 1-(5-chloro-1-ethyl-6-keto-pyridazin-4-yl)isonipecotate Formula: C12H15ClN3O3- MolecularWeight: 284.7188

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C(C=N1)N2CCC(CC2)C(=O)[O-])Cl

Isomeric SMILES

CCN1C(=O)C(=C(C=N1)N2CCC(CC2)C(=O)[O-])Cl

InChI

InChI=1S/C12H16ClN3O3/c1-2-16-11(17)10(13)9(7-14-16)15-5-3-8(4-6-15)12(18)19/h7-8H,2-6H2,1H3,(H,18,19)/p-1