[4-[3-(aminomethyl)-4-fluoranyl-phenyl]piperidin-1-yl]-(5-phenethylpyridin-3-yl)methanone

Systemtic Name: [4-[3-(aminomethyl)-4-fluoranyl-phenyl]piperidin-1-yl]-(5-phenethylpyridin-3-yl)methanone Openeye Name: [4-[3-(aminomethyl)-4-fluoro-phenyl]-1-piperidyl]-(5-phenethyl-3-pyridyl)methanone CAS Name: [4-[3-(aminomethyl)-4-fluorophenyl]-1-piperidinyl]-(5-phenethyl-3-pyridinyl)methanone IUPAC Name: [4-[3-(aminomethyl)-4-fluorophenyl]piperidin-1-yl]-(5-phenethylpyridin-3-yl)methanone Traditional Name: [4-[3-(aminomethyl)-4-fluoro-phenyl]piperidino]-(5-phenethyl-3-pyridyl)methanone Formula: C26H28FN3O MolecularWeight: 417.518423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC(=C(C=C2)F)CN)C(=O)C3=CC(=CN=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=CC(=C(C=C2)F)CN)C(=O)C3=CC(=CN=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H28FN3O/c27-25-9-8-22(15-23(25)16-28)21-10-12-30(13-11-21)26(31)24-14-20(17-29-18-24)7-6-19-4-2-1-3-5-19/h1-5,8-9,14-15,17-18,21H,6-7,10-13,16,28H2