O1-methyl O3-(phenanthridin-6-ylmethyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(phenanthridin-6-ylmethyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-(phenanthridin-6-ylmethyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(6-phenanthridinylmethyl) ester IUPAC Name: 1-O-methyl 3-O-(phenanthridin-6-ylmethyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(phenanthridin-6-ylmethyl) ester Formula: C23H16N2O6 MolecularWeight: 416.38294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C23H16N2O6/c1-30-22(26)14-10-15(12-16(11-14)25(28)29)23(27)31-13-21-19-8-3-2-6-17(19)18-7-4-5-9-20(18)24-21/h2-12H,13H2,1H3