2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide

Systemtic Name: 2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[3-(2-ketopyrrolidino)propyl]acetamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCCN3CCCC3=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCCN3CCCC3=O

InChI

InChI=1S/C21H30N4O3/c1-17(26)18-5-7-19(8-6-18)24-14-12-23(13-15-24)16-20(27)22-9-3-11-25-10-2-4-21(25)28/h5-8H,2-4,9-16H2,1H3,(H,22,27)/p+1