3,6,6-trimethyl-1-[4-(trifluoromethyloxy)phenyl]-5,7-dihydroindazol-4-one

Systemtic Name: 3,6,6-trimethyl-1-[4-(trifluoromethyloxy)phenyl]-5,7-dihydroindazol-4-one Openeye Name: 3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-5,7-dihydroindazol-4-one CAS Name: 3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-5,7-dihydroindazol-4-one IUPAC Name: 3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-5,7-dihydroindazol-4-one Traditional Name: 3,6,6-trimethyl-1-[4-(trifluoromethoxy)phenyl]-5,7-dihydroindazol-4-one Formula: C17H17F3N2O2 MolecularWeight: 338.32429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C17H17F3N2O2/c1-10-15-13(8-16(2,3)9-14(15)23)22(21-10)11-4-6-12(7-5-11)24-17(18,19)20/h4-7H,8-9H2,1-3H3