[5-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-6-oxidanylidene-piperidin-3-yl] 2-oxidanylideneethanoate

Systemtic Name: [5-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-6-oxidanylidene-piperidin-3-yl] 2-oxidanylideneethanoate Openeye Name: [5-(4-nitro-1,3-dioxo-isoindolin-2-yl)-6-oxo-3-piperidyl] 2-oxoacetate CAS Name: 2-oxoacetic acid [5-(4-nitro-1,3-dioxo-2-isoindolyl)-6-oxo-3-piperidinyl] ester IUPAC Name: [5-(4-nitro-1,3-dioxoisoindol-2-yl)-6-oxopiperidin-3-yl] 2-oxoacetate Traditional Name: 2-ketoacetic acid [5-(1,3-diketo-4-nitro-isoindolin-2-yl)-6-keto-3-piperidyl] ester Formula: C15H11N3O8 MolecularWeight: 361.26314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC(=O)C=O

Isomeric SMILES

C1C(CNC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])OC(=O)C=O

InChI

InChI=1S/C15H11N3O8/c19-6-11(20)26-7-4-10(13(21)16-5-7)17-14(22)8-2-1-3-9(18(24)25)12(8)15(17)23/h1-3,6-7,10H,4-5H2,(H,16,21)