2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]isoindoline-1,3-quinone Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H17N3O3/c1-16-6-8-17(9-7-16)13(19)10-18-14(20)11-4-2-3-5-12(11)15(18)21/h2-5H,6-10H2,1H3/p+1