2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-propyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxo-propyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[3-(4-methyl-1-piperazin-4-iumyl)-3-oxopropyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[3-(4-methylpiperazin-4-ium-1-yl)-3-oxopropyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[3-keto-3-(4-methylpiperazin-4-ium-1-yl)propyl]benzo[de]isoquinoline-1,3-quinone Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C20H21N3O3/c1-21-10-12-22(13-11-21)17(24)8-9-23-19(25)15-6-2-4-14-5-3-7-16(18(14)15)20(23)26/h2-7H,8-13H2,1H3/p+1