O1-methyl O3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] ester IUPAC Name: 1-O-methyl 3-O-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl] ester Formula: C18H13N3O7 MolecularWeight: 383.31172

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C18H13N3O7/c1-26-17(22)12-7-13(9-14(8-12)21(24)25)18(23)27-10-15-19-20-16(28-15)11-5-3-2-4-6-11/h2-9H,10H2,1H3