2-(3-piperazin-4-ium-1-ylpropyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(3-piperazin-4-ium-1-ylpropyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(3-piperazin-4-ium-1-ylpropyl)benzo[de]isoquinoline-1,3-dione CAS Name: 2-[3-(1-piperazin-4-iumyl)propyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(3-piperazin-4-ium-1-ylpropyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(3-piperazin-4-ium-1-ylpropyl)benzo[de]isoquinoline-1,3-quinone Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C1CN(CC[NH2+]1)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C19H21N3O2/c23-18-15-6-1-4-14-5-2-7-16(17(14)15)19(24)22(18)11-3-10-21-12-8-20-9-13-21/h1-2,4-7,20H,3,8-13H2/p+1