N-(4-fluoranyl-3-piperidin-4-yl-phenyl)-5-(2-phenoxyphenyl)pentanamide

Systemtic Name: N-(4-fluoranyl-3-piperidin-4-yl-phenyl)-5-(2-phenoxyphenyl)pentanamide Openeye Name: N-[4-fluoro-3-(4-piperidyl)phenyl]-5-(2-phenoxyphenyl)pentanamide CAS Name: N-[4-fluoro-3-(4-piperidinyl)phenyl]-5-(2-phenoxyphenyl)pentanamide IUPAC Name: N-(4-fluoro-3-piperidin-4-ylphenyl)-5-(2-phenoxyphenyl)pentanamide Traditional Name: N-[4-fluoro-3-(4-piperidyl)phenyl]-5-(2-phenoxyphenyl)valeramide Formula: C28H31FN2O2 MolecularWeight: 446.556343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C=CC(=C2)NC(=O)CCCCC3=CC=CC=C3OC4=CC=CC=C4)F

Isomeric SMILES

C1CNCCC1C2=C(C=CC(=C2)NC(=O)CCCCC3=CC=CC=C3OC4=CC=CC=C4)F

InChI

InChI=1S/C28H31FN2O2/c29-26-15-14-23(20-25(26)21-16-18-30-19-17-21)31-28(32)13-7-5-9-22-8-4-6-12-27(22)33-24-10-2-1-3-11-24/h1-4,6,8,10-12,14-15,20-21,30H,5,7,9,13,16-19H2,(H,31,32)