3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide

Systemtic Name: 3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide Openeye Name: 3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide CAS Name: 3-[1-[(1-ethyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]propanamide IUPAC Name: 3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propanamide Traditional Name: 3-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]propionamide Formula: C21H39N5O+2 MolecularWeight: 377.56726

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)CCC2CC[NH+](CC2)CC3=CN(N=C3)CC

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)CCC2CC[NH+](CC2)CC3=CN(N=C3)CC

InChI

InChI=1S/C21H37N5O/c1-3-25-11-5-6-20(25)15-22-21(27)8-7-18-9-12-24(13-10-18)16-19-14-23-26(4-2)17-19/h14,17-18,20H,3-13,15-16H2,1-2H3,(H,22,27)/p+2/t20-/m0/s1