ethyl N-[(E)-[1-ethyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: ethyl N-[(E)-[1-ethyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]carbamate Openeye Name: ethyl N-[(E)-[1-ethyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]carbamate CAS Name: N-[(E)-[1-ethyl-3-(5-nitro-2-furanyl)-4-pyrazolyl]methylideneamino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-[1-ethyl-3-(5-nitrofuran-2-yl)pyrazol-4-yl]methylideneamino]carbamate Traditional Name: N-[(E)-[1-ethyl-3-(5-nitro-2-furyl)pyrazol-4-yl]methyleneamino]carbamic acid ethyl ester Formula: C13H15N5O5 MolecularWeight: 321.2887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])C=NNC(=O)OCC

Isomeric SMILES

CCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])/C=N/NC(=O)OCC

InChI

InChI=1S/C13H15N5O5/c1-3-17-8-9(7-14-15-13(19)22-4-2)12(16-17)10-5-6-11(23-10)18(20)21/h5-8H,3-4H2,1-2H3,(H,15,19)/b14-7+