propyl 5-methyl-3-(5-nitrofuran-2-yl)-1,2-oxazole-4-carboxylate

Systemtic Name: propyl 5-methyl-3-(5-nitrofuran-2-yl)-1,2-oxazole-4-carboxylate Openeye Name: propyl 5-methyl-3-(5-nitro-2-furyl)isoxazole-4-carboxylate CAS Name: 5-methyl-3-(5-nitro-2-furanyl)-4-isoxazolecarboxylic acid propyl ester IUPAC Name: propyl 5-methyl-3-(5-nitrofuran-2-yl)-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-(5-nitro-2-furyl)isoxazole-4-carboxylic acid propyl ester Formula: C12H12N2O6 MolecularWeight: 280.23348

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(ON=C1C2=CC=C(O2)[N+](=O)[O-])C

Isomeric SMILES

CCCOC(=O)C1=C(ON=C1C2=CC=C(O2)[N+](=O)[O-])C

InChI

InChI=1S/C12H12N2O6/c1-3-6-18-12(15)10-7(2)20-13-11(10)8-4-5-9(19-8)14(16)17/h4-5H,3,6H2,1-2H3