2-[9-(3,5-dimethoxy-4-phenyl-phenoxy)nonyl]isoindole-1,3-dione

Systemtic Name: 2-[9-(3,5-dimethoxy-4-phenyl-phenoxy)nonyl]isoindole-1,3-dione Openeye Name: 2-[9-(3,5-dimethoxy-4-phenyl-phenoxy)nonyl]isoindoline-1,3-dione CAS Name: 2-[9-(3,5-dimethoxy-4-phenylphenoxy)nonyl]isoindole-1,3-dione IUPAC Name: 2-[9-(3,5-dimethoxy-4-phenylphenoxy)nonyl]isoindole-1,3-dione Traditional Name: 2-[9-(3,5-dimethoxy-4-phenyl-phenoxy)nonyl]isoindoline-1,3-quinone Formula: C31H35NO5 MolecularWeight: 501.6133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1C2=CC=CC=C2)OC)OCCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC(=CC(=C1C2=CC=CC=C2)OC)OCCCCCCCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C31H35NO5/c1-35-27-21-24(22-28(36-2)29(27)23-15-9-8-10-16-23)37-20-14-7-5-3-4-6-13-19-32-30(33)25-17-11-12-18-26(25)31(32)34/h8-12,15-18,21-22H,3-7,13-14,19-20H2,1-2H3