6,7-dimethoxy-3-[[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]-oxidanyl-methylidene]-1H-quinoline-2,4-dione

Systemtic Name: 6,7-dimethoxy-3-[[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]-oxidanyl-methylidene]-1H-quinoline-2,4-dione Openeye Name: 3-[hydroxy-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: 3-[hydroxy-[3-(4-methyl-1-piperazine-1,4-diiumyl)propylamino]methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: 3-[hydroxy-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: 3-[hydroxy-[3-(4-methylpiperazine-1,4-diium-1-yl)propylamino]methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C20H30N4O5+2 MolecularWeight: 406.476

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O

InChI

InChI=1S/C20H28N4O5/c1-23-7-9-24(10-8-23)6-4-5-21-19(26)17-18(25)13-11-15(28-2)16(29-3)12-14(13)22-20(17)27/h11-12,21,26H,4-10H2,1-3H3,(H,22,27)/p+2