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

Systemtic Name: O1-ethyl O3-[(3-methyl-1,2-oxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[(3-methylisoxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[(3-methyl-5-isoxazolyl)methyl] ester IUPAC Name: 1-O-ethyl 3-O-[(3-methyl-1,2-oxazol-5-yl)methyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[(3-methylisoxazol-5-yl)methyl] ester Formula: C15H14N2O7 MolecularWeight: 334.28086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O7/c1-3-22-14(18)10-5-11(7-12(6-10)17(20)21)15(19)23-8-13-4-9(2)16-24-13/h4-7H,3,8H2,1-2H3