2-(2-azanyl-5-nitro-phenyl)-4,5,6,7-tetrakis(bromanyl)isoindole-1,3-dione

Systemtic Name: 2-(2-azanyl-5-nitro-phenyl)-4,5,6,7-tetrakis(bromanyl)isoindole-1,3-dione Openeye Name: 2-(2-amino-5-nitro-phenyl)-4,5,6,7-tetrabromo-isoindoline-1,3-dione CAS Name: 2-(2-amino-5-nitrophenyl)-4,5,6,7-tetrabromoisoindole-1,3-dione IUPAC Name: 2-(2-amino-5-nitrophenyl)-4,5,6,7-tetrabromoisoindole-1,3-dione Traditional Name: 2-(2-amino-5-nitro-phenyl)-4,5,6,7-tetrabromo-isoindoline-1,3-quinone Formula: C14H5Br4N3O4 MolecularWeight: 598.8232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])N2C(=O)C3=C(C2=O)C(=C(C(=C3Br)Br)Br)Br)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])N2C(=O)C3=C(C2=O)C(=C(C(=C3Br)Br)Br)Br)N

InChI

InChI=1S/C14H5Br4N3O4/c15-9-7-8(10(16)12(18)11(9)17)14(23)20(13(7)22)6-3-4(21(24)25)1-2-5(6)19/h1-3H,19H2