5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-2-methoxy-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-methoxy-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 5-[(1,3-dioxo-2-isoindolyl)methyl]-2-methoxy-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxy-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 2-methoxy-N-(4-methylpiperazin-4-ium-1-yl)-5-(phthalimidomethyl)benzamide Formula: C22H25N4O4+ MolecularWeight: 409.4583

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)CN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C22H24N4O4/c1-24-9-11-25(12-10-24)23-20(27)18-13-15(7-8-19(18)30-2)14-26-21(28)16-5-3-4-6-17(16)22(26)29/h3-8,13H,9-12,14H2,1-2H3,(H,23,27)/p+1