5-methyl-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxylate

Systemtic Name: 5-methyl-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxylate Openeye Name: 5-methyl-4-[(4-nitrophenoxy)methyl]isoxazole-3-carboxylate CAS Name: 5-methyl-4-[(4-nitrophenoxy)methyl]-3-isoxazolecarboxylate IUPAC Name: 5-methyl-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-methyl-4-[(4-nitrophenoxy)methyl]isoxazole-3-carboxylate Formula: C12H9N2O6- MolecularWeight: 277.20966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)[O-])COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C(=O)[O-])COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O6/c1-7-10(11(12(15)16)13-20-7)6-19-9-4-2-8(3-5-9)14(17)18/h2-5H,6H2,1H3,(H,15,16)/p-1