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

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[(4-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-(4-fluorobenzyl)isonipecotamide Formula: C20H21ClF2N2O3S MolecularWeight: 442.907146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(C=C2)F)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H21ClF2N2O3S/c21-18-2-1-3-19(23)17(18)13-29(27,28)25-10-8-15(9-11-25)20(26)24-12-14-4-6-16(22)7-5-14/h1-7,15H,8-13H2,(H,24,26)