ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate Openeye Name: ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate CAS Name: 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylate Traditional Name: 3-(3-nitrophenyl)-1H-pyrazole-5-carboxylic acid ethyl ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=NN1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O4/c1-2-19-12(16)11-7-10(13-14-11)8-4-3-5-9(6-8)15(17)18/h3-7H,2H2,1H3,(H,13,14)