2-fluoranyl-N-[2-(piperidin-1-ium-1-ylmethyl)-3H-benzimidazol-5-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-(piperidin-1-ium-1-ylmethyl)-3H-benzimidazol-5-yl]benzamide Openeye Name: 2-fluoro-N-[2-(piperidin-1-ium-1-ylmethyl)-3H-benzimidazol-5-yl]benzamide CAS Name: 2-fluoro-N-[2-(1-piperidin-1-iumylmethyl)-3H-benzimidazol-5-yl]benzamide IUPAC Name: 2-fluoro-N-[2-(piperidin-1-ium-1-ylmethyl)-3H-benzimidazol-5-yl]benzamide Traditional Name: 2-fluoro-N-[2-(piperidin-1-ium-1-ylmethyl)-3H-benzimidazol-5-yl]benzamide Formula: C20H22FN4O+ MolecularWeight: 353.413283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=NC3=C(N2)C=C(C=C3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CC[NH+](CC1)CC2=NC3=C(N2)C=C(C=C3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C20H21FN4O/c21-16-7-3-2-6-15(16)20(26)22-14-8-9-17-18(12-14)24-19(23-17)13-25-10-4-1-5-11-25/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,22,26)(H,23,24)/p+1