2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C31H18N4O5 MolecularWeight: 526.49842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)NC(=N3)C4=CC(=CC=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)OC7=CC=C(C=C7)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)NC(=N3)C4=CC(=CC=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)OC7=CC=C(C=C7)[N+](=O)[O-]

InChI

InChI=1S/C31H18N4O5/c36-30-25-13-12-24(40-23-10-8-21(9-11-23)35(38)39)17-26(25)31(37)34(30)22-7-3-6-20(14-22)29-32-27-15-18-4-1-2-5-19(18)16-28(27)33-29/h1-17H,(H,32,33)