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

Systemtic Name: O1-methyl O3-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl] ester IUPAC Name: 1-O-methyl 3-O-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methyl] ester Formula: C19H15N3O7 MolecularWeight: 397.3383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=CC(=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O7/c1-11-3-5-12(6-4-11)17-20-16(29-21-17)10-28-19(24)14-7-13(18(23)27-2)8-15(9-14)22(25)26/h3-9H,10H2,1-2H3