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

Systemtic Name: 4-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 4-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 4-[2-(1-methyl-1-piperazin-1-iumyl)ethyl]isoindole-1,3-dione IUPAC Name: 4-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 4-[2-(1-methylpiperazin-1-ium-1-yl)ethyl]isoindoline-1,3-quinone Formula: C15H20N3O2+ MolecularWeight: 274.3382

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CCC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

C[N+]1(CCNCC1)CCC2=CC=CC3=C2C(=O)NC3=O

InChI

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