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

Systemtic Name: 3-ethyl-5-(2-nitrophenyl)-1,2-oxazole-4-carboxylate Openeye Name: 3-ethyl-5-(2-nitrophenyl)isoxazole-4-carboxylate CAS Name: 3-ethyl-5-(2-nitrophenyl)-4-isoxazolecarboxylate IUPAC Name: 3-ethyl-5-(2-nitrophenyl)-1,2-oxazole-4-carboxylate Traditional Name: 3-ethyl-5-(2-nitrophenyl)isoxazole-4-carboxylate Formula: C12H9N2O5- MolecularWeight: 261.21026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)[O-])C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=NOC(=C1C(=O)[O-])C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O5/c1-2-8-10(12(15)16)11(19-13-8)7-5-3-4-6-9(7)14(17)18/h3-6H,2H2,1H3,(H,15,16)/p-1