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

Systemtic Name: 4-nitro-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]isoindole-1,3-dione Openeye Name: 4-nitro-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]isoindoline-1,3-dione CAS Name: 4-nitro-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]isoindole-1,3-dione IUPAC Name: 4-nitro-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(4-phenylpiperazino)ethyl]-4-nitro-isoindoline-1,3-quinone Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c25-17(22-11-9-21(10-12-22)14-5-2-1-3-6-14)13-23-19(26)15-7-4-8-16(24(28)29)18(15)20(23)27/h1-8H,9-13H2