(2-methoxy-5-nitro-phenyl) 2-benzo[e][1]benzofuran-1-ylethanoate

Systemtic Name: (2-methoxy-5-nitro-phenyl) 2-benzo[e][1]benzofuran-1-ylethanoate Openeye Name: (2-methoxy-5-nitro-phenyl) 2-benzo[e]benzofuran-1-ylacetate CAS Name: 2-(1-benzo[e]benzofuranyl)acetic acid (2-methoxy-5-nitrophenyl) ester IUPAC Name: (2-methoxy-5-nitrophenyl) 2-benzo[e][1]benzofuran-1-ylacetate Traditional Name: 2-benzo[e]benzofuran-1-ylacetic acid (2-methoxy-5-nitro-phenyl) ester Formula: C21H15NO6 MolecularWeight: 377.3469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OC(=O)CC2=COC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C21H15NO6/c1-26-17-9-7-15(22(24)25)11-19(17)28-20(23)10-14-12-27-18-8-6-13-4-2-3-5-16(13)21(14)18/h2-9,11-12H,10H2,1H3