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

Systemtic Name: O1-methyl O3-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl] ester IUPAC Name: 1-O-methyl 3-O-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(3-isobutyl-1,2,4-oxadiazol-5-yl)methyl] ester O1-methyl ester Formula: C16H17N3O7 MolecularWeight: 363.32208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=CC(=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O7/c1-9(2)4-13-17-14(26-18-13)8-25-16(21)11-5-10(15(20)24-3)6-12(7-11)19(22)23/h5-7,9H,4,8H2,1-3H3