2-[2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-[2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-[2-[(3-bromophenyl)methylene]-3-oxo-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-[2-[(3-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-[2-[(3-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-[2-(3-bromobenzylidene)-3-keto-1,4-benzoxazin-4-yl]-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C24H27BrN3O4+ MolecularWeight: 501.39288

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CN2C3=CC=CC=C3OC(=CC4=CC(=CC=C4)Br)C2=O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CN2C3=CC=CC=C3OC(=CC4=CC(=CC=C4)Br)C2=O

InChI

InChI=1S/C24H26BrN3O4/c25-19-6-3-5-18(15-19)16-22-24(30)28(20-7-1-2-8-21(20)32-22)17-23(29)26-9-4-10-27-11-13-31-14-12-27/h1-3,5-8,15-16H,4,9-14,17H2,(H,26,29)/p+1