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

Systemtic Name: N-[2-(1-cyclobutylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-fluoranyl-benzamide Openeye Name: N-[2-(1-cyclobutylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-fluoro-benzamide CAS Name: N-[2-(1-cyclobutyl-4-piperidin-1-iumyl)-3-pyrazolyl]-3-fluorobenzamide IUPAC Name: N-[2-(1-cyclobutylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-fluorobenzamide Traditional Name: N-[2-(1-cyclobutylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-fluoro-benzamide Formula: C19H24FN4O+ MolecularWeight: 343.418463

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CC(C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C19H23FN4O/c20-15-4-1-3-14(13-15)19(25)22-18-7-10-21-24(18)17-8-11-23(12-9-17)16-5-2-6-16/h1,3-4,7,10,13,16-17H,2,5-6,8-9,11-12H2,(H,22,25)/p+1