2-benzo[e][1]benzofuran-1-yl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]ethanamide

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]acetamide Formula: C24H25N4O2+ MolecularWeight: 401.4809

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C24H24N4O2/c1-27-10-12-28(13-11-27)22-9-7-19(15-25-22)26-23(29)14-18-16-30-21-8-6-17-4-2-3-5-20(17)24(18)21/h2-9,15-16H,10-14H2,1H3,(H,26,29)/p+1