N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[e][1]benzofuran-2-carboxamide

Systemtic Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[e][1]benzofuran-2-carboxamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[e]benzofuran-2-carboxamide CAS Name: N-[3-(4-methyl-1-piperazin-4-iumyl)propyl]-2-benzo[e]benzofurancarboxamide IUPAC Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[e][1]benzofuran-2-carboxamide Traditional Name: N-[3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[e]benzofuran-2-carboxamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCCNC(=O)C2=CC3=C(O2)C=CC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)CCCNC(=O)C2=CC3=C(O2)C=CC4=CC=CC=C43

InChI

InChI=1S/C21H25N3O2/c1-23-11-13-24(14-12-23)10-4-9-22-21(25)20-15-18-17-6-3-2-5-16(17)7-8-19(18)26-20/h2-3,5-8,15H,4,9-14H2,1H3,(H,22,25)/p+1