1-[1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-5-fluoranyl-benzotriazole

Systemtic Name: 1-[1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-5-fluoranyl-benzotriazole Openeye Name: 1-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-5-fluoro-benzotriazole CAS Name: 1-[1-[(1-cyclohexyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]-5-fluorobenzotriazole IUPAC Name: 1-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-5-fluorobenzotriazole Traditional Name: 1-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-5-fluoro-benzotriazole Formula: C19H26FN8+ MolecularWeight: 385.461743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCC(CC3)N4C5=C(C=C(C=C5)F)N=N4

InChI

InChI=1S/C19H25FN8/c20-14-6-7-18-17(12-14)21-24-27(18)16-8-10-26(11-9-16)13-19-22-23-25-28(19)15-4-2-1-3-5-15/h6-7,12,15-16H,1-5,8-11,13H2/p+1