N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-quinolin-5-yl-ethanediamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-quinolin-5-yl-ethanediamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-(5-quinolyl)oxamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-N'-(5-quinolinyl)oxamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-quinolin-5-yloxamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-N'-(5-quinolyl)oxamide Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C(=O)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C(=O)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C18H22N4O2/c1-2-22-11-5-6-13(22)12-20-17(23)18(24)21-16-9-3-8-15-14(16)7-4-10-19-15/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H,20,23)(H,21,24)/p+1/t13-/m0/s1