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

Systemtic Name: O3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[(3,5-dimethylisoxazol-4-yl)methyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(3,5-dimethyl-4-isoxazolyl)methyl] ester O1-ethyl ester IUPAC Name: 3-O-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[(3,5-dimethylisoxazol-4-yl)methyl] ester O1-ethyl ester Formula: C16H16N2O7 MolecularWeight: 348.30744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=C(ON=C2C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC2=C(ON=C2C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O7/c1-4-23-15(19)11-5-12(7-13(6-11)18(21)22)16(20)24-8-14-9(2)17-25-10(14)3/h5-7H,4,8H2,1-3H3