2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(3-oxidanylidenepiperazin-1-ium-1-yl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-(3-oxo-1-piperazin-1-iumyl)-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(3-oxopiperazin-1-ium-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-(3-ketopiperazin-1-ium-1-yl)-N-[3-(2-ketopyrrolidino)phenyl]acetamide Formula: C16H21N4O3+ MolecularWeight: 317.36294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCNC(=O)C3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C16H20N4O3/c21-14-10-19(8-6-17-14)11-15(22)18-12-3-1-4-13(9-12)20-7-2-5-16(20)23/h1,3-4,9H,2,5-8,10-11H2,(H,17,21)(H,18,22)/p+1