N-(2-methoxydibenzofuran-3-yl)-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2-methoxydibenzofuran-3-yl)-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide Openeye Name: N-(2-methoxydibenzofuran-3-yl)-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide CAS Name: N-(2-methoxy-3-dibenzofuranyl)-4-(4-methyl-1-piperazin-4-iumyl)-3-nitrobenzamide IUPAC Name: N-(2-methoxydibenzofuran-3-yl)-4-(4-methylpiperazin-4-ium-1-yl)-3-nitrobenzamide Traditional Name: N-(2-methoxydibenzofuran-3-yl)-4-(4-methylpiperazin-4-ium-1-yl)-3-nitro-benzamide Formula: C25H25N4O5+ MolecularWeight: 461.4898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=C4C5=CC=CC=C5OC4=C3)OC)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=C4C5=CC=CC=C5OC4=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O5/c1-27-9-11-28(12-10-27)20-8-7-16(13-21(20)29(31)32)25(30)26-19-15-23-18(14-24(19)33-2)17-5-3-4-6-22(17)34-23/h3-8,13-15H,9-12H2,1-2H3,(H,26,30)/p+1