2-(2-piperazin-4-ium-1-ylethyl)isoindole-1,3-dione

Systemtic Name: 2-(2-piperazin-4-ium-1-ylethyl)isoindole-1,3-dione Openeye Name: 2-(2-piperazin-4-ium-1-ylethyl)isoindoline-1,3-dione CAS Name: 2-[2-(1-piperazin-4-iumyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-(2-piperazin-4-ium-1-ylethyl)isoindole-1,3-dione Traditional Name: 2-(2-piperazin-4-ium-1-ylethyl)isoindoline-1,3-quinone Formula: C14H18N3O2+ MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CN(CC[NH2+]1)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C14H17N3O2/c18-13-11-3-1-2-4-12(11)14(19)17(13)10-9-16-7-5-15-6-8-16/h1-4,15H,5-10H2/p+1