O3-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(2-ethoxycarbonylbenzofuran-3-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(2-ethoxycarbonyl-3-benzofuranyl)methyl] ester O1-methyl ester IUPAC Name: 3-O-[(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(2-carbethoxybenzofuran-3-yl)methyl] ester O1-methyl ester Formula: C21H17NO9 MolecularWeight: 427.36098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H17NO9/c1-3-29-21(25)18-16(15-6-4-5-7-17(15)31-18)11-30-20(24)13-8-12(19(23)28-2)9-14(10-13)22(26)27/h4-10H,3,11H2,1-2H3