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

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]acetamide Formula: C25H26N3O4S+ MolecularWeight: 464.55664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O4S/c1-27-12-14-28(15-13-27)33(30,31)21-9-7-20(8-10-21)26-24(29)16-19-17-32-23-11-6-18-4-2-3-5-22(18)25(19)23/h2-11,17H,12-16H2,1H3,(H,26,29)/p+1