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

Systemtic Name: O3-[(1-cyanoindolizin-2-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(1-cyanoindolizin-2-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(1-cyano-2-indolizinyl)methyl] ester O1-methyl ester IUPAC Name: 3-O-[(1-cyanoindolizin-2-yl)methyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(1-cyanoindolizin-2-yl)methyl] ester O1-methyl ester Formula: C19H13N3O6 MolecularWeight: 379.32302

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C19H13N3O6/c1-27-18(23)12-6-13(8-15(7-12)22(25)26)19(24)28-11-14-10-21-5-3-2-4-17(21)16(14)9-20/h2-8,10H,11H2,1H3