5-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)triazole-4-carboxamide CAS Name: 5-methyl-1-phenyl-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-4-triazolecarboxamide IUPAC Name: 5-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)triazole-4-carboxamide Traditional Name: 5-methyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)triazole-4-carboxamide Formula: C19H28N5O+ MolecularWeight: 342.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3CC([NH2+]C(C3)(C)C)(C)C

Isomeric SMILES

CC1=C(N=NN1C2=CC=CC=C2)C(=O)NC3CC([NH2+]C(C3)(C)C)(C)C

InChI

InChI=1S/C19H27N5O/c1-13-16(21-23-24(13)15-9-7-6-8-10-15)17(25)20-14-11-18(2,3)22-19(4,5)12-14/h6-10,14,22H,11-12H2,1-5H3,(H,20,25)/p+1