4,5,6,7-tetrakis(bromanyl)-2-(4-phenoxyphenyl)isoindole-1,3-dione

Systemtic Name: 4,5,6,7-tetrakis(bromanyl)-2-(4-phenoxyphenyl)isoindole-1,3-dione Openeye Name: 4,5,6,7-tetrabromo-2-(4-phenoxyphenyl)isoindoline-1,3-dione CAS Name: 4,5,6,7-tetrabromo-2-(4-phenoxyphenyl)isoindole-1,3-dione IUPAC Name: 4,5,6,7-tetrabromo-2-(4-phenoxyphenyl)isoindole-1,3-dione Traditional Name: 4,5,6,7-tetrabromo-2-(4-phenoxyphenyl)isoindoline-1,3-quinone Formula: C20H9Br4NO3 MolecularWeight: 630.90636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C(=C(C(=C4Br)Br)Br)Br

InChI

InChI=1S/C20H9Br4NO3/c21-15-13-14(16(22)18(24)17(15)23)20(27)25(19(13)26)10-6-8-12(9-7-10)28-11-4-2-1-3-5-11/h1-9H