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

Systemtic Name: 2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-(4-bromo-2-chloro-6-methyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-(4-bromo-2-chloro-6-methylphenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-(4-bromo-2-chloro-6-methyl-phenoxy)-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Formula: C18H27BrClN2O2+ MolecularWeight: 418.77618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C)Cl)Br

InChI

InChI=1S/C18H26BrClN2O2/c1-11-6-12(19)7-14(20)16(11)24-10-15(23)21-13-8-17(2,3)22-18(4,5)9-13/h6-7,13,22H,8-10H2,1-5H3,(H,21,23)/p+1