1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile

Systemtic Name: 1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile Openeye Name: 1-hexyl-3-(5-nitro-2-furyl)pyrazole-4-carbonitrile CAS Name: 1-hexyl-3-(5-nitro-2-furanyl)-4-pyrazolecarbonitrile IUPAC Name: 1-hexyl-3-(5-nitrofuran-2-yl)pyrazole-4-carbonitrile Traditional Name: 1-hexyl-3-(5-nitro-2-furyl)pyrazole-4-carbonitrile Formula: C14H16N4O3 MolecularWeight: 288.30184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])C#N

Isomeric SMILES

CCCCCCN1C=C(C(=N1)C2=CC=C(O2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H16N4O3/c1-2-3-4-5-8-17-10-11(9-15)14(16-17)12-6-7-13(21-12)18(19)20/h6-7,10H,2-5,8H2,1H3