ethyl 3-methyl-4-(4-nitrophenyl)-5H-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-4-(4-nitrophenyl)-5H-1,2-oxazole-4-carboxylate Openeye Name: ethyl 3-methyl-4-(4-nitrophenyl)-5H-isoxazole-4-carboxylate CAS Name: 3-methyl-4-(4-nitrophenyl)-5H-isoxazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(4-nitrophenyl)-5H-1,2-oxazole-4-carboxylate Traditional Name: 3-methyl-4-(4-nitrophenyl)-2-isoxazoline-4-carboxylic acid ethyl ester Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CON=C1C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1(CON=C1C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5/c1-3-19-12(16)13(8-20-14-9(13)2)10-4-6-11(7-5-10)15(17)18/h4-7H,3,8H2,1-2H3