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

Systemtic Name: 3,5-dimethyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Openeye Name: 3,5-dimethyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide CAS Name: 3,5-dimethyl-1-phenyl-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-4-pyrazolecarboxamide IUPAC Name: 3,5-dimethyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Traditional Name: 3,5-dimethyl-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)pyrazole-4-carboxamide Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O/c1-14-18(15(2)25(23-14)17-10-8-7-9-11-17)19(26)22-16-12-20(3,4)24-21(5,6)13-16/h7-11,16,24H,12-13H2,1-6H3,(H,22,26)/p+1