1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[4-(1-pyrazolyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-(4-pyrazol-1-ylphenyl)isonipecotamide Formula: C22H22ClFN4O MolecularWeight: 412.887683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H22ClFN4O/c23-20-3-1-4-21(24)19(20)15-27-13-9-16(10-14-27)22(29)26-17-5-7-18(8-6-17)28-12-2-11-25-28/h1-8,11-12,16H,9-10,13-15H2,(H,26,29)