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

Systemtic Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(4-methylpiperazine-1,4-diium-1-yl)methyl]isoindoline-1,3-quinone Formula: C14H19N3O2+2 MolecularWeight: 261.31956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O2/c1-15-6-8-16(9-7-15)10-17-13(18)11-4-2-3-5-12(11)14(17)19/h2-5H,6-10H2,1H3/p+2