2-[4-(6-bromanyl-2-methoxy-quinolin-3-yl)-3-oxidanyl-3,4-diphenyl-butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(6-bromanyl-2-methoxy-quinolin-3-yl)-3-oxidanyl-3,4-diphenyl-butyl]isoindole-1,3-dione Openeye Name: 2-[4-(6-bromo-2-methoxy-3-quinolyl)-3-hydroxy-3,4-diphenyl-butyl]isoindoline-1,3-dione CAS Name: 2-[4-(6-bromo-2-methoxy-3-quinolinyl)-3-hydroxy-3,4-diphenylbutyl]isoindole-1,3-dione IUPAC Name: 2-[4-(6-bromo-2-methoxyquinolin-3-yl)-3-hydroxy-3,4-diphenylbutyl]isoindole-1,3-dione Traditional Name: 2-[4-(6-bromo-2-methoxy-3-quinolyl)-3-hydroxy-3,4-diphenyl-butyl]isoindoline-1,3-quinone Formula: C34H27BrN2O4 MolecularWeight: 607.49318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=C(C=CC2=N1)Br)C(C3=CC=CC=C3)C(CCN4C(=O)C5=CC=CC=C5C4=O)(C6=CC=CC=C6)O

Isomeric SMILES

COC1=C(C=C2C=C(C=CC2=N1)Br)C(C3=CC=CC=C3)C(CCN4C(=O)C5=CC=CC=C5C4=O)(C6=CC=CC=C6)O

InChI

InChI=1S/C34H27BrN2O4/c1-41-31-28(21-23-20-25(35)16-17-29(23)36-31)30(22-10-4-2-5-11-22)34(40,24-12-6-3-7-13-24)18-19-37-32(38)26-14-8-9-15-27(26)33(37)39/h2-17,20-21,30,40H,18-19H2,1H3