N-(5-chloranyl-2-phenoxy-phenyl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-chloranyl-2-phenoxy-phenyl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-chloro-2-phenoxy-phenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-chloro-2-phenoxyphenyl)-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(5-chloro-2-phenoxyphenyl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-chloro-2-phenoxy-phenyl)-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C18H19ClN3O3+ MolecularWeight: 360.81476

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3

InChI

InChI=1S/C18H18ClN3O3/c19-13-6-7-16(25-14-4-2-1-3-5-14)15(10-13)21-18(24)12-22-9-8-20-17(23)11-22/h1-7,10H,8-9,11-12H2,(H,20,23)(H,21,24)/p+1