2-(2-piperazine-1,4-diium-1-ylethyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-piperazine-1,4-diium-1-ylethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2-piperazine-1,4-diium-1-ylethyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-[2-(1-piperazine-1,4-diiumyl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-piperazine-1,4-diium-1-ylethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2-piperazine-1,4-diium-1-ylethyl)benzo[de]isoquinoline-1,3-quinone Formula: C18H21N3O2+2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C18H19N3O2/c22-17-14-5-1-3-13-4-2-6-15(16(13)14)18(23)21(17)12-11-20-9-7-19-8-10-20/h1-6,19H,7-12H2/p+2