2-chloranyl-N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-chloranyl-N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-chloro-N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-chloro-N-[2-[1-[(4-fluorophenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-chloro-N-[2-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-chloro-N-[2-[1-(4-fluorobenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C22H23ClFN4O+ MolecularWeight: 413.895623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl)CC4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC=CC=C3Cl)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H22ClFN4O/c23-20-4-2-1-3-19(20)22(29)26-21-9-12-25-28(21)18-10-13-27(14-11-18)15-16-5-7-17(24)8-6-16/h1-9,12,18H,10-11,13-15H2,(H,26,29)/p+1