2-(2-nitro-3-phenyl-1-benzofuran-6-yl)isoindole-1,3-dione

Systemtic Name: 2-(2-nitro-3-phenyl-1-benzofuran-6-yl)isoindole-1,3-dione Openeye Name: 2-(2-nitro-3-phenyl-benzofuran-6-yl)isoindoline-1,3-dione CAS Name: 2-(2-nitro-3-phenyl-6-benzofuranyl)isoindole-1,3-dione IUPAC Name: 2-(2-nitro-3-phenyl-1-benzofuran-6-yl)isoindole-1,3-dione Traditional Name: 2-(2-nitro-3-phenyl-benzofuran-6-yl)isoindoline-1,3-quinone Formula: C22H12N2O5 MolecularWeight: 384.34108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C2C=CC(=C3)N4C(=O)C5=CC=CC=C5C4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C2C=CC(=C3)N4C(=O)C5=CC=CC=C5C4=O)[N+](=O)[O-]

InChI

InChI=1S/C22H12N2O5/c25-20-15-8-4-5-9-16(15)21(26)23(20)14-10-11-17-18(12-14)29-22(24(27)28)19(17)13-6-2-1-3-7-13/h1-12H