2-fluoranyl-N-[1-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[1-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzamide Openeye Name: 2-fluoro-N-[1-[(1-phenethyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzamide CAS Name: 2-fluoro-N-[1-[(1-phenethyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: 2-fluoro-N-[1-[(1-phenethyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzamide Traditional Name: 2-fluoro-N-[1-[(1-phenethyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzamide Formula: C22H26FN6O+ MolecularWeight: 409.479843

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2F)CC3=NN=NN3CCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2F)CC3=NN=NN3CCC4=CC=CC=C4

InChI

InChI=1S/C22H25FN6O/c23-20-9-5-4-8-19(20)22(30)24-18-11-13-28(14-12-18)16-21-25-26-27-29(21)15-10-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H,24,30)/p+1