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(1-butyl-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl) benzoate

(1-butyl-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl) benzoate

Systemtic Name:(1-butyl-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl) benzoate
Openeye Name:(1-butyl-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl) benzoate
CAS Name:benzoic acid (1-butyl-2,2,6,6-tetramethyl-1-piperidin-1-iumyl) ester
IUPAC Name:(1-butyl-2,2,6,6-tetramethylpiperidin-1-ium-1-yl) benzoate
Traditional Name:benzoic acid (1-butyl-2,2,6,6-tetramethyl-piperidin-1-ium-1-yl) ester
Formula: C20H32NO2+
MolecularWeight: 318.47358
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C(CCCC1(C)C)(C)C)OC(=O)C2=CC=CC=C2


Isomeric SMILES

CCCC[N+]1(C(CCCC1(C)C)(C)C)OC(=O)C2=CC=CC=C2


InChI

InChI=1S/C20H32NO2/c1-6-7-16-21(19(2,3)14-11-15-20(21,4)5)23-18(22)17-12-9-8-10-13-17/h8-10,12-13H,6-7,11,14-16H2,1-5H3/q+1


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