3-fluoranyl-N-[2-[1-(oxan-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[2-[1-(oxan-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 3-fluoro-N-[2-(1-tetrahydropyran-4-ylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide CAS Name: 3-fluoro-N-[2-[1-(4-oxanyl)-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 3-fluoro-N-[2-[1-(oxan-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 3-fluoro-N-[2-(1-tetrahydropyran-4-ylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide Formula: C20H26FN4O2+ MolecularWeight: 373.444443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)F)C4CCOCC4

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CC(=CC=C3)F)C4CCOCC4

InChI

InChI=1S/C20H25FN4O2/c21-16-3-1-2-15(14-16)20(26)23-19-4-9-22-25(19)18-5-10-24(11-6-18)17-7-12-27-13-8-17/h1-4,9,14,17-18H,5-8,10-13H2,(H,23,26)/p+1