2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]isoindoline-1,3-quinone Formula: C15H21N3O2+2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H19N3O2/c1-16-6-8-17(9-7-16)10-11-18-14(19)12-4-2-3-5-13(12)15(18)20/h2-5H,6-11H2,1H3/p+2