2-[4-[[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[(4-nitro-1,3-dioxo-isoindolin-2-yl)methyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[(4-nitro-1,3-dioxo-2-isoindolyl)methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[(4-nitro-1,3-dioxoisoindol-2-yl)methyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[(1,3-diketo-4-nitro-isoindolin-2-yl)methyl]piperazino]isonicotinonitrile Formula: C19H16N6O4 MolecularWeight: 392.36814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=NC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCN1CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=NC=CC(=C4)C#N

InChI

InChI=1S/C19H16N6O4/c20-11-13-4-5-21-16(10-13)23-8-6-22(7-9-23)12-24-18(26)14-2-1-3-15(25(28)29)17(14)19(24)27/h1-5,10H,6-9,12H2