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

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]propanamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]propanamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]propionamide Formula: C21H36N4O+2 MolecularWeight: 360.53674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)CCC2CC[NH+](CC2)CC3=CC=CC=N3

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)CCC2CC[NH+](CC2)CC3=CC=CC=N3

InChI

InChI=1S/C21H34N4O/c1-2-25-13-5-7-20(25)16-23-21(26)9-8-18-10-14-24(15-11-18)17-19-6-3-4-12-22-19/h3-4,6,12,18,20H,2,5,7-11,13-17H2,1H3,(H,23,26)/p+2/t20-/m0/s1