(4-acetamidophenyl) 1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxylate

Systemtic Name: (4-acetamidophenyl) 1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxylate Openeye Name: (4-acetamidophenyl) 1-(6-chloropyridazin-3-yl)piperidine-3-carboxylate CAS Name: 1-(6-chloro-3-pyridazinyl)-3-piperidinecarboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 1-(6-chloropyridazin-3-yl)piperidine-3-carboxylate Traditional Name: 1-(6-chloropyridazin-3-yl)nipecotic acid (4-acetamidophenyl) ester Formula: C18H19ClN4O3 MolecularWeight: 374.82146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4O3/c1-12(24)20-14-4-6-15(7-5-14)26-18(25)13-3-2-10-23(11-13)17-9-8-16(19)21-22-17/h4-9,13H,2-3,10-11H2,1H3,(H,20,24)