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

Systemtic Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione CAS Name: 5-nitro-2-[2-(1-piperazinyl)ethyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 5-nitro-2-(2-piperazin-1-ylethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 5-nitro-2-(2-piperazinoethyl)benzo[de]isoquinoline-1,3-quinone Formula: C18H18N4O4 MolecularWeight: 354.35992

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4/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