N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-[4-(2-ketopyrrolidino)phenyl]-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]acetamide Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H27N5O2/c1-25-11-13-26(14-12-25)20-9-6-18(16-23-20)24-21(28)15-17-4-7-19(8-5-17)27-10-2-3-22(27)29/h4-9,16H,2-3,10-15H2,1H3,(H,24,28)/p+1