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

Systemtic Name: O1-methyl O3-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[(5-methyl-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-methyl-1,3,4-oxadiazol-2-yl)methyl] ester IUPAC Name: 1-O-methyl 3-O-[(5-methyl-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-methyl-1,3,4-oxadiazol-2-yl)methyl] ester Formula: C13H11N3O7 MolecularWeight: 321.24234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(O1)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O7/c1-7-14-15-11(23-7)6-22-13(18)9-3-8(12(17)21-2)4-10(5-9)16(19)20/h3-5H,6H2,1-2H3