5-nitro-2-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 5-nitro-2-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 5-nitro-2-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 5-nitro-2-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5/c25-17(22-9-7-21(8-10-22)16-3-1-2-6-20-16)12-23-18(26)14-5-4-13(24(28)29)11-15(14)19(23)27/h1-6,11H,7-10,12H2