1-(2-nitrophenyl)-5-propyl-pyrazole-4-carboxylate

Systemtic Name: 1-(2-nitrophenyl)-5-propyl-pyrazole-4-carboxylate Openeye Name: 1-(2-nitrophenyl)-5-propyl-pyrazole-4-carboxylate CAS Name: 1-(2-nitrophenyl)-5-propyl-4-pyrazolecarboxylate IUPAC Name: 1-(2-nitrophenyl)-5-propylpyrazole-4-carboxylate Traditional Name: 1-(2-nitrophenyl)-5-propyl-pyrazole-4-carboxylate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H13N3O4/c1-2-5-10-9(13(17)18)8-14-15(10)11-6-3-4-7-12(11)16(19)20/h3-4,6-8H,2,5H2,1H3,(H,17,18)/p-1