2-(2-acetyloxy-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-(2-acetyloxy-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(2-acetoxy-4-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-acetyloxy-4-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(2-acetyloxy-4-nitrophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-acetoxy-4-nitro-phenyl)-1,3-diketo-isoindoline-5-carboxylate Formula: C17H9N2O8- MolecularWeight: 369.26196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC(=O)OC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H10N2O8/c1-8(20)27-14-7-10(19(25)26)3-5-13(14)18-15(21)11-4-2-9(17(23)24)6-12(11)16(18)22/h2-7H,1H3,(H,23,24)/p-1