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

Systemtic Name: 1-(5-chloranyl-6-oxidanylidene-1-phenyl-pyridazin-4-yl)piperidine-4-carboxylate Openeye Name: 1-(5-chloro-6-oxo-1-phenyl-pyridazin-4-yl)piperidine-4-carboxylate CAS Name: 1-(5-chloro-6-oxo-1-phenyl-4-pyridazinyl)-4-piperidinecarboxylate IUPAC Name: 1-(5-chloro-6-oxo-1-phenylpyridazin-4-yl)piperidine-4-carboxylate Traditional Name: 1-(5-chloro-6-keto-1-phenyl-pyridazin-4-yl)isonipecotate Formula: C16H15ClN3O3- MolecularWeight: 332.7616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)[O-])C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C16H16ClN3O3/c17-14-13(19-8-6-11(7-9-19)16(22)23)10-18-20(15(14)21)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H,22,23)/p-1