2-(2-bromanyl-4-ethyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Formula: C19H30BrN2O2+ MolecularWeight: 398.3577

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Br

InChI

InChI=1S/C19H29BrN2O2/c1-6-13-7-8-16(15(20)9-13)24-12-17(23)21-14-10-18(2,3)22-19(4,5)11-14/h7-9,14,22H,6,10-12H2,1-5H3,(H,21,23)/p+1