1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-fluoranyl-benzotriazole

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-fluoranyl-benzotriazole Openeye Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-fluoro-benzotriazole CAS Name: 1-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-5-fluorobenzotriazole IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-fluorobenzotriazole Traditional Name: 1-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-5-fluoro-benzotriazole Formula: C18H19ClFN4+ MolecularWeight: 345.821663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C3=C(C=C(C=C3)F)N=N2)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1N2C3=C(C=C(C=C3)F)N=N2)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H18ClFN4/c19-14-3-1-13(2-4-14)12-23-9-7-16(8-10-23)24-18-6-5-15(20)11-17(18)21-22-24/h1-6,11,16H,7-10,12H2/p+1