1-[2-(4-chlorophenyl)-6-fluoranyl-quinolin-4-yl]-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-(4-chlorophenyl)-6-fluoranyl-quinolin-4-yl]-N-methyl-piperidine-4-carboxamide Openeye Name: 1-[2-(4-chlorophenyl)-6-fluoro-4-quinolyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-[2-(4-chlorophenyl)-6-fluoro-4-quinolinyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(4-chlorophenyl)-6-fluoroquinolin-4-yl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-[2-(4-chlorophenyl)-6-fluoro-4-quinolyl]-N-methyl-isonipecotamide Formula: C22H21ClFN3O MolecularWeight: 397.873043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CCN(CC1)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=C(C=C4)Cl

Isomeric SMILES

CNC(=O)C1CCN(CC1)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClFN3O/c1-25-22(28)15-8-10-27(11-9-15)21-13-20(14-2-4-16(23)5-3-14)26-19-7-6-17(24)12-18(19)21/h2-7,12-13,15H,8-11H2,1H3,(H,25,28)