N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-(phenylcarbonyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-(phenylcarbonyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(4-bromo-2-chloro-phenyl)acetamide CAS Name: 2-(4-benzoyl-1-piperidin-1-iumyl)-N-(4-bromo-2-chlorophenyl)acetamide IUPAC Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(4-bromo-2-chlorophenyl)acetamide Traditional Name: 2-(4-benzoylpiperidin-1-ium-1-yl)-N-(4-bromo-2-chloro-phenyl)acetamide Formula: C20H21BrClN2O2+ MolecularWeight: 436.74994

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)C2=CC=CC=C2)CC(=O)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C20H20BrClN2O2/c21-16-6-7-18(17(22)12-16)23-19(25)13-24-10-8-15(9-11-24)20(26)14-4-2-1-3-5-14/h1-7,12,15H,8-11,13H2,(H,23,25)/p+1