ethyl 5-nitro-2-propyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-nitro-2-propyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-nitro-2-propyl-pyrazole-3-carboxylate CAS Name: 5-nitro-2-propyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-2-propylpyrazole-3-carboxylate Traditional Name: 5-nitro-2-propyl-pyrazole-3-carboxylic acid ethyl ester Formula: C9H13N3O4 MolecularWeight: 227.21722

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=N1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCN1C(=CC(=N1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C9H13N3O4/c1-3-5-11-7(9(13)16-4-2)6-8(10-11)12(14)15/h6H,3-5H2,1-2H3