[4-(2-fluorophenyl)piperazin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone

Systemtic Name: [4-(2-fluorophenyl)piperazin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone Openeye Name: [4-(2-fluorophenyl)piperazin-1-yl]-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]methanone CAS Name: [4-(2-fluorophenyl)-1-piperazinyl]-[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]methanone IUPAC Name: [4-(2-fluorophenyl)piperazin-1-yl]-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]methanone Traditional Name: [4-(2-fluorophenyl)piperazino]-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]methanone Formula: C22H28FN4O+ MolecularWeight: 383.482323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCN(CC2)C3=CC=CC=C3F)CC4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCN(CC2)C3=CC=CC=C3F)CC4=CC=CC=N4

InChI

InChI=1S/C22H27FN4O/c23-20-6-1-2-7-21(20)26-13-15-27(16-14-26)22(28)18-8-11-25(12-9-18)17-19-5-3-4-10-24-19/h1-7,10,18H,8-9,11-17H2/p+1