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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=NC(=NO2)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=NC(=NO2)C(C)C)[N+](=O)[O-]

InChI

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