5,5-dimethyl-3-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-6,7-dihydroindazol-4-one

Systemtic Name: 5,5-dimethyl-3-phenyl-1-[2,2,2-tris(fluoranyl)ethyl]-6,7-dihydroindazol-4-one Openeye Name: 5,5-dimethyl-3-phenyl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one CAS Name: 5,5-dimethyl-3-phenyl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one IUPAC Name: 5,5-dimethyl-3-phenyl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one Traditional Name: 5,5-dimethyl-3-phenyl-1-(2,2,2-trifluoroethyl)-6,7-dihydroindazol-4-one Formula: C17H17F3N2O MolecularWeight: 322.32489

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(C1=O)C(=NN2CC(F)(F)F)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CCC2=C(C1=O)C(=NN2CC(F)(F)F)C3=CC=CC=C3)C

InChI

InChI=1S/C17H17F3N2O/c1-16(2)9-8-12-13(15(16)23)14(11-6-4-3-5-7-11)21-22(12)10-17(18,19)20/h3-7H,8-10H2,1-2H3