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

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(2-benzoyl-4-bromophenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C20H22BrN2O2+ MolecularWeight: 402.30488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21BrN2O2/c21-16-9-10-18(22-19(24)14-23-11-5-2-6-12-23)17(13-16)20(25)15-7-3-1-4-8-15/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,22,24)/p+1