N-(4-ethanoylphenyl)-4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide

Systemtic Name: N-(4-ethanoylphenyl)-4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-(4-acetylphenyl)-4-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-(4-acetylphenyl)-4-(5-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(4-acetylphenyl)-4-(5-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: N-(4-acetylphenyl)-4-(1,3-diketo-5-nitro-isoindolin-2-yl)benzamide Formula: C23H15N3O6 MolecularWeight: 429.3817

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H15N3O6/c1-13(27)14-2-6-16(7-3-14)24-21(28)15-4-8-17(9-5-15)25-22(29)19-11-10-18(26(31)32)12-20(19)23(25)30/h2-12H,1H3,(H,24,28)