2-(7-bromanylphenanthren-3-yl)isoindole-1,3-dione

Systemtic Name: 2-(7-bromanylphenanthren-3-yl)isoindole-1,3-dione Openeye Name: 2-(7-bromo-3-phenanthryl)isoindoline-1,3-dione CAS Name: 2-(7-bromo-3-phenanthrenyl)isoindole-1,3-dione IUPAC Name: 2-(7-bromophenanthren-3-yl)isoindole-1,3-dione Traditional Name: 2-(7-bromo-3-phenanthryl)isoindoline-1,3-quinone Formula: C22H12BrNO2 MolecularWeight: 402.24018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC4=C(C=C3)C=CC5=C4C=CC(=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC4=C(C=C3)C=CC5=C4C=CC(=C5)Br

InChI

InChI=1S/C22H12BrNO2/c23-15-8-10-17-14(11-15)6-5-13-7-9-16(12-20(13)17)24-21(25)18-3-1-2-4-19(18)22(24)26/h1-12H