[4-chloranyl-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] ethanoate

Systemtic Name: [4-chloranyl-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] ethanoate Openeye Name: [4-chloro-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)phenyl] acetate CAS Name: acetic acid [4-chloro-2-(5-nitro-1,3-dioxo-2-isoindolyl)phenyl] ester IUPAC Name: [4-chloro-2-(5-nitro-1,3-dioxoisoindol-2-yl)phenyl] acetate Traditional Name: acetic acid [4-chloro-2-(1,3-diketo-5-nitro-isoindolin-2-yl)phenyl] ester Formula: C16H9ClN2O6 MolecularWeight: 360.70546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H9ClN2O6/c1-8(20)25-14-5-2-9(17)6-13(14)18-15(21)11-4-3-10(19(23)24)7-12(11)16(18)22/h2-7H,1H3