4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate

Systemtic Name: 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate Openeye Name: 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate CAS Name: 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate IUPAC Name: 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate Traditional Name: 4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzoate Formula: C15H12F3N2O2- MolecularWeight: 309.26319

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H13F3N2O2/c16-15(17,18)13-11-3-1-2-4-12(11)20(19-13)10-7-5-9(6-8-10)14(21)22/h5-8H,1-4H2,(H,21,22)/p-1