5-(4-bromanylphenoxy)-2-(3-methylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(4-bromanylphenoxy)-2-(3-methylphenyl)isoindole-1,3-dione Openeye Name: 5-(4-bromophenoxy)-2-(m-tolyl)isoindoline-1,3-dione CAS Name: 5-(4-bromophenoxy)-2-(3-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-(4-bromophenoxy)-2-(3-methylphenyl)isoindole-1,3-dione Traditional Name: 5-(4-bromophenoxy)-2-(m-tolyl)isoindoline-1,3-quinone Formula: C21H14BrNO3 MolecularWeight: 408.24476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H14BrNO3/c1-13-3-2-4-15(11-13)23-20(24)18-10-9-17(12-19(18)21(23)25)26-16-7-5-14(22)6-8-16/h2-12H,1H3