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

Systemtic Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-3-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]-3-(2-oxopyrrolidin-1-yl)benzamide CAS Name: N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-3-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]-3-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide Formula: C21H26N5O2+ MolecularWeight: 380.46344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O2/c1-24-10-12-25(13-11-24)19-8-7-17(15-22-19)23-21(28)16-4-2-5-18(14-16)26-9-3-6-20(26)27/h2,4-5,7-8,14-15H,3,6,9-13H2,1H3,(H,23,28)/p+1