(2-phenoxyphenyl)methyl 1-(6-chloranylpyridazin-3-yl)piperidine-4-carboxylate

Systemtic Name: (2-phenoxyphenyl)methyl 1-(6-chloranylpyridazin-3-yl)piperidine-4-carboxylate Openeye Name: (2-phenoxyphenyl)methyl 1-(6-chloropyridazin-3-yl)piperidine-4-carboxylate CAS Name: 1-(6-chloro-3-pyridazinyl)-4-piperidinecarboxylic acid (2-phenoxyphenyl)methyl ester IUPAC Name: (2-phenoxyphenyl)methyl 1-(6-chloropyridazin-3-yl)piperidine-4-carboxylate Traditional Name: 1-(6-chloropyridazin-3-yl)isonipecotic acid (2-phenoxybenzyl) ester Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=CC=C2OC3=CC=CC=C3)C4=NN=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=CC=C2OC3=CC=CC=C3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN3O3/c24-21-10-11-22(26-25-21)27-14-12-17(13-15-27)23(28)29-16-18-6-4-5-9-20(18)30-19-7-2-1-3-8-19/h1-11,17H,12-16H2