ethyl 1-(4-nitrophenyl)-4-oxidanyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 1-(4-nitrophenyl)-4-oxidanyl-pyrazole-3-carboxylate Openeye Name: ethyl 4-hydroxy-1-(4-nitrophenyl)pyrazole-3-carboxylate CAS Name: 4-hydroxy-1-(4-nitrophenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-1-(4-nitrophenyl)pyrazole-3-carboxylate Traditional Name: 4-hydroxy-1-(4-nitrophenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C=C1O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NN(C=C1O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5/c1-2-20-12(17)11-10(16)7-14(13-11)8-3-5-9(6-4-8)15(18)19/h3-7,16H,2H2,1H3