4-isocyanato-3-(5-nitrofuran-2-yl)-1-phenyl-pyrazole

Systemtic Name: 4-isocyanato-3-(5-nitrofuran-2-yl)-1-phenyl-pyrazole Openeye Name: 4-isocyanato-3-(5-nitro-2-furyl)-1-phenyl-pyrazole CAS Name: 4-isocyanato-3-(5-nitro-2-furanyl)-1-phenylpyrazole IUPAC Name: 4-isocyanato-3-(5-nitrofuran-2-yl)-1-phenylpyrazole Traditional Name: 4-isocyanato-3-(5-nitro-2-furyl)-1-phenyl-pyrazole Formula: C14H8N4O4 MolecularWeight: 296.23772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])N=C=O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(O3)[N+](=O)[O-])N=C=O

InChI

InChI=1S/C14H8N4O4/c19-9-15-11-8-17(10-4-2-1-3-5-10)16-14(11)12-6-7-13(22-12)18(20)21/h1-8H