N-tert-butyl-4-[5-(3-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide

Systemtic Name: N-tert-butyl-4-[5-(3-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-tert-butyl-4-[5-(3-nitrophenoxy)-1,3-dioxo-isoindolin-2-yl]benzamide CAS Name: N-tert-butyl-4-[5-(3-nitrophenoxy)-1,3-dioxo-2-isoindolyl]benzamide IUPAC Name: N-tert-butyl-4-[5-(3-nitrophenoxy)-1,3-dioxoisoindol-2-yl]benzamide Traditional Name: N-tert-butyl-4-[1,3-diketo-5-(3-nitrophenoxy)isoindolin-2-yl]benzamide Formula: C25H21N3O6 MolecularWeight: 459.45074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O6/c1-25(2,3)26-22(29)15-7-9-16(10-8-15)27-23(30)20-12-11-19(14-21(20)24(27)31)34-18-6-4-5-17(13-18)28(32)33/h4-14H,1-3H3,(H,26,29)