2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-[4-(2-methyl-1-oxopropyl)-1-piperazin-1-iumyl]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(2-methylpropanoyl)piperazin-1-ium-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-(4-isobutyrylpiperazin-1-ium-1-yl)-N-[3-(2-ketopyrrolidino)phenyl]acetamide Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)N3CCCC3=O

Isomeric SMILES

CC(C)C(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC(=C2)N3CCCC3=O

InChI

InChI=1S/C20H28N4O3/c1-15(2)20(27)23-11-9-22(10-12-23)14-18(25)21-16-5-3-6-17(13-16)24-8-4-7-19(24)26/h3,5-6,13,15H,4,7-12,14H2,1-2H3,(H,21,25)/p+1