N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-morpholin-4-ium-4-yl-propanamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-3-morpholin-4-ium-4-yl-propanamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-3-morpholin-4-ium-4-yl-propanamide CAS Name: N-(2-benzoyl-4-bromophenyl)-3-(4-morpholin-4-iumyl)propanamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-3-morpholin-4-ium-4-ylpropanamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-3-morpholin-4-ium-4-yl-propionamide Formula: C20H22BrN2O3+ MolecularWeight: 418.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21BrN2O3/c21-16-6-7-18(17(14-16)20(25)15-4-2-1-3-5-15)22-19(24)8-9-23-10-12-26-13-11-23/h1-7,14H,8-13H2,(H,22,24)/p+1