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

Systemtic Name: N-(2-methylpropyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-isobutyl-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-methylpropyl)-2-[4-(2-pyridinylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-methylpropyl)-2-[4-(pyridin-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-isobutyl-2-[4-(2-pyridylmethyl)piperazin-1-ium-1-yl]acetamide Formula: C16H27N4O+ MolecularWeight: 291.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O/c1-14(2)11-18-16(21)13-20-9-7-19(8-10-20)12-15-5-3-4-6-17-15/h3-6,14H,7-13H2,1-2H3,(H,18,21)/p+1