N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-2-(2-nitrophenoxy)acetamide Formula: C21H21FN4O4 MolecularWeight: 412.414243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)COC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O4/c1-21(2,3)18-12-19(25(24-18)15-10-8-14(22)9-11-15)23-20(27)13-30-17-7-5-4-6-16(17)26(28)29/h4-12H,13H2,1-3H3,(H,23,27)