2-(4-tert-butyl-2-nitro-phenyl)-4,5,6,7-tetrakis(chloranyl)isoindole-1,3-dione

Systemtic Name: 2-(4-tert-butyl-2-nitro-phenyl)-4,5,6,7-tetrakis(chloranyl)isoindole-1,3-dione Openeye Name: 2-(4-tert-butyl-2-nitro-phenyl)-4,5,6,7-tetrachloro-isoindoline-1,3-dione CAS Name: 2-(4-tert-butyl-2-nitrophenyl)-4,5,6,7-tetrachloroisoindole-1,3-dione IUPAC Name: 2-(4-tert-butyl-2-nitrophenyl)-4,5,6,7-tetrachloroisoindole-1,3-dione Traditional Name: 2-(4-tert-butyl-2-nitro-phenyl)-4,5,6,7-tetrachloro-isoindoline-1,3-quinone Formula: C18H12Cl4N2O4 MolecularWeight: 462.11088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C(=C(C(=C3Cl)Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H12Cl4N2O4/c1-18(2,3)7-4-5-8(9(6-7)24(27)28)23-16(25)10-11(17(23)26)13(20)15(22)14(21)12(10)19/h4-6H,1-3H3