N-(propylcarbamoyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(propylcarbamoyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(propylcarbamoyl)-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[oxo(propylamino)methyl]-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(propylcarbamoyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(propylcarbamoyl)-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C16H26N5O2+ MolecularWeight: 320.40994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=N2

Isomeric SMILES

CCCNC(=O)NC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=N2

InChI

InChI=1S/C16H25N5O2/c1-2-6-18-16(23)19-15(22)13-21-10-8-20(9-11-21)12-14-5-3-4-7-17-14/h3-5,7H,2,6,8-13H2,1H3,(H2,18,19,22,23)/p+1