1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[4-(cyanomethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-N-[4-(cyanomethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-N-[4-(cyanomethyl)phenyl]nipecotamide Formula: C21H21ClFN3O MolecularWeight: 385.862343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C=CC=C2Cl)F)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1CC(CN(C1)CC2=C(C=CC=C2Cl)F)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C21H21ClFN3O/c22-19-4-1-5-20(23)18(19)14-26-12-2-3-16(13-26)21(27)25-17-8-6-15(7-9-17)10-11-24/h1,4-9,16H,2-3,10,12-14H2,(H,25,27)