4-[4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]benzenecarbonitrile

Systemtic Name: 4-[4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenoxy]benzenecarbonitrile Openeye Name: 4-[4-(5-nitro-1,3-dioxo-isoindolin-2-yl)phenoxy]benzonitrile CAS Name: 4-[4-(5-nitro-1,3-dioxo-2-isoindolyl)phenoxy]benzonitrile IUPAC Name: 4-[4-(5-nitro-1,3-dioxoisoindol-2-yl)phenoxy]benzonitrile Traditional Name: 4-[4-(1,3-diketo-5-nitro-isoindolin-2-yl)phenoxy]benzonitrile Formula: C21H11N3O5 MolecularWeight: 385.32914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H11N3O5/c22-12-13-1-6-16(7-2-13)29-17-8-3-14(4-9-17)23-20(25)18-10-5-15(24(27)28)11-19(18)21(23)26/h1-11H