2-benzo[e][1]benzofuran-1-yl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27N3O2/c1-2-28-13-15-29(16-14-28)23-10-6-5-9-22(23)27-25(30)17-20-18-31-24-12-11-19-7-3-4-8-21(19)26(20)24/h3-12,18H,2,13-17H2,1H3,(H,27,30)/p+1