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

Systemtic Name: O1-methyl O3-[1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl] ester IUPAC Name: 1-O-methyl 3-O-[1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl] ester Formula: C18H14N4O7 MolecularWeight: 398.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O7/c1-10(16-20-15(21-29-16)11-4-3-5-19-9-11)28-18(24)13-6-12(17(23)27-2)7-14(8-13)22(25)26/h3-10H,1-2H3