5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione hydrochloride

Systemtic Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione hydrochloride Openeye Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione hydrochloride CAS Name: 5-nitro-2-[2-(1-piperazinyl)ethyl]benzo[de]isoquinoline-1,3-dione hydrochloride IUPAC Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione hydrochloride Traditional Name: 5-nitro-2-(2-piperazinoethyl)benzo[de]isoquinoline-1,3-quinone hydrochloride Formula: C18H19ClN4O4 MolecularWeight: 390.82086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-].Cl

Isomeric SMILES

C1CN(CCN1)CCN2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-].Cl

InChI

InChI=1S/C18H18N4O4.ClH/c23-17-14-3-1-2-12-10-13(22(25)26)11-15(16(12)14)18(24)21(17)9-8-20-6-4-19-5-7-20;/h1-3,10-11,19H,4-9H2;1H