4-[[(4-bromophenyl)carbonylamino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide

Systemtic Name: 4-[[(4-bromophenyl)carbonylamino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 4-[[[(4-bromophenyl)-oxomethyl]amino]methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C21H25BrN3O3+ MolecularWeight: 447.3455

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O3/c22-19-7-5-18(6-8-19)21(27)24-15-16-1-3-17(4-2-16)20(26)23-9-10-25-11-13-28-14-12-25/h1-8H,9-15H2,(H,23,26)(H,24,27)/p+1