2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-[3-(1,3-benzoxazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C27H15N3O6 MolecularWeight: 477.4245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)OC6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC(=CC=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)OC6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C27H15N3O6/c31-26-21-13-12-20(35-19-10-8-17(9-11-19)30(33)34)15-22(21)27(32)29(26)18-5-3-4-16(14-18)25-28-23-6-1-2-7-24(23)36-25/h1-15H