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

Systemtic Name: (3-nitrophenyl)methyl 3,5-dimethyl-1,2-oxazole-4-carboxylate Openeye Name: (3-nitrophenyl)methyl 3,5-dimethylisoxazole-4-carboxylate CAS Name: 3,5-dimethyl-4-isoxazolecarboxylic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3,5-dimethyl-1,2-oxazole-4-carboxylate Traditional Name: 3,5-dimethylisoxazole-4-carboxylic acid (3-nitrobenzyl) ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O5/c1-8-12(9(2)20-14-8)13(16)19-7-10-4-3-5-11(6-10)15(17)18/h3-6H,7H2,1-2H3