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

Systemtic Name: (3-nitrophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate Openeye Name: (3-nitrophenyl) 3,5-dimethylisoxazole-4-carboxylate CAS Name: 3,5-dimethyl-4-isoxazolecarboxylic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 3,5-dimethyl-1,2-oxazole-4-carboxylate Traditional Name: 3,5-dimethylisoxazole-4-carboxylic acid (3-nitrophenyl) ester Formula: C12H10N2O5 MolecularWeight: 262.2182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)OC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)OC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O5/c1-7-11(8(2)19-13-7)12(15)18-10-5-3-4-9(6-10)14(16)17/h3-6H,1-2H3