methyl 2-[1-(4-nitrophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[1-(4-nitrophenyl)-5-oxidanylidene-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[1-(4-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetate CAS Name: 2-[1-(4-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(4-nitrophenyl)-5-oxo-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-1-(4-nitrophenyl)-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C12H11N3O5 MolecularWeight: 277.23284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NN(C(=O)C1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=NN(C(=O)C1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5/c1-20-12(17)7-8-6-11(16)14(13-8)9-2-4-10(5-3-9)15(18)19/h2-5H,6-7H2,1H3