5-(3-nitrophenoxy)-6-(4-phenylmethoxyphenoxy)-4-propyl-isoindole-1,3-dione

Systemtic Name: 5-(3-nitrophenoxy)-6-(4-phenylmethoxyphenoxy)-4-propyl-isoindole-1,3-dione Openeye Name: 6-(4-benzyloxyphenoxy)-5-(3-nitrophenoxy)-4-propyl-isoindoline-1,3-dione CAS Name: 5-(3-nitrophenoxy)-6-(4-phenylmethoxyphenoxy)-4-propylisoindole-1,3-dione IUPAC Name: 5-(3-nitrophenoxy)-6-(4-phenylmethoxyphenoxy)-4-propylisoindole-1,3-dione Traditional Name: 6-(4-benzoxyphenoxy)-5-(3-nitrophenoxy)-4-propyl-isoindoline-1,3-quinone Formula: C30H24N2O7 MolecularWeight: 524.52076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=C1OC3=CC=CC(=C3)[N+](=O)[O-])OC4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)NC2=O

Isomeric SMILES

CCCC1=C2C(=CC(=C1OC3=CC=CC(=C3)[N+](=O)[O-])OC4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)NC2=O

InChI

InChI=1S/C30H24N2O7/c1-2-7-24-27-25(29(33)31-30(27)34)17-26(28(24)39-23-11-6-10-20(16-23)32(35)36)38-22-14-12-21(13-15-22)37-18-19-8-4-3-5-9-19/h3-6,8-17H,2,7,18H2,1H3,(H,31,33,34)