(4-ethanoylphenyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: (4-ethanoylphenyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: (4-acetylphenyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid (4-acetylphenyl) ester Formula: C22H19FN2O3 MolecularWeight: 378.396263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=NN(C3=C2CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN2O3/c1-14(26)15-6-12-18(13-7-15)28-22(27)21-19-4-2-3-5-20(19)25(24-21)17-10-8-16(23)9-11-17/h6-13H,2-5H2,1H3