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

Systemtic Name: 4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-nitrophenyl)benzamide Openeye Name: 4-(5-nitro-1,3-dioxo-isoindolin-2-yl)-N-(4-nitrophenyl)benzamide CAS Name: 4-(5-nitro-1,3-dioxo-2-isoindolyl)-N-(4-nitrophenyl)benzamide IUPAC Name: 4-(5-nitro-1,3-dioxoisoindol-2-yl)-N-(4-nitrophenyl)benzamide Traditional Name: 4-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-(4-nitrophenyl)benzamide Formula: C21H12N4O7 MolecularWeight: 432.34258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H12N4O7/c26-19(22-13-3-7-15(8-4-13)24(29)30)12-1-5-14(6-2-12)23-20(27)17-10-9-16(25(31)32)11-18(17)21(23)28/h1-11H,(H,22,26)