1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]benzotriazole

Systemtic Name: 1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]benzotriazole Openeye Name: 1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]benzotriazole CAS Name: 1-[1-[(4-fluorophenyl)methyl]-4-piperidin-1-iumyl]benzotriazole IUPAC Name: 1-[1-[(4-fluorophenyl)methyl]piperidin-1-ium-4-yl]benzotriazole Traditional Name: 1-[1-(4-fluorobenzyl)piperidin-1-ium-4-yl]benzotriazole Formula: C18H20FN4+ MolecularWeight: 311.376603

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C3=CC=CC=C3N=N2)CC4=CC=C(C=C4)F

Isomeric SMILES

C1C[NH+](CCC1N2C3=CC=CC=C3N=N2)CC4=CC=C(C=C4)F

InChI

InChI=1S/C18H19FN4/c19-15-7-5-14(6-8-15)13-22-11-9-16(10-12-22)23-18-4-2-1-3-17(18)20-21-23/h1-8,16H,9-13H2/p+1