4-[4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[6-(1,3-dioxoisoindolin-2-yl)hexyl]piperazin-1-yl]benzonitrile CAS Name: 4-[4-[6-(1,3-dioxo-2-isoindolyl)hexyl]-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-[6-(1,3-dioxoisoindol-2-yl)hexyl]piperazin-1-yl]benzonitrile Traditional Name: 4-[4-(6-phthalimidohexyl)piperazino]benzonitrile Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1CCCCCCN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H28N4O2/c26-19-20-9-11-21(12-10-20)28-17-15-27(16-18-28)13-5-1-2-6-14-29-24(30)22-7-3-4-8-23(22)25(29)31/h3-4,7-12H,1-2,5-6,13-18H2