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

Systemtic Name: 1-[1-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzotriazole Openeye Name: 1-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzotriazole CAS Name: 1-[1-[(1-tert-butyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]benzotriazole IUPAC Name: 1-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzotriazole Traditional Name: 1-[1-[(1-tert-butyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]benzotriazole Formula: C17H25N8+ MolecularWeight: 341.434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=NN=N1)C[NH+]2CCC(CC2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)(C)N1C(=NN=N1)C[NH+]2CCC(CC2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H24N8/c1-17(2,3)25-16(19-20-22-25)12-23-10-8-13(9-11-23)24-15-7-5-4-6-14(15)18-21-24/h4-7,13H,8-12H2,1-3H3/p+1