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

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-(2-methoxy-5-nitrophenyl)-3-(4-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-3-(4-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)benzamide Formula: C22H14N4O8 MolecularWeight: 462.36856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O8/c1-34-18-9-8-14(25(30)31)11-16(18)23-20(27)12-4-2-5-13(10-12)24-21(28)15-6-3-7-17(26(32)33)19(15)22(24)29/h2-11H,1H3,(H,23,27)