1-[2,2-dimethyl-3-oxidanyl-6-(trifluoromethyloxy)-3,4-dihydrochromen-4-yl]-5-methyl-2H-indazol-3-one

Systemtic Name: 1-[2,2-dimethyl-3-oxidanyl-6-(trifluoromethyloxy)-3,4-dihydrochromen-4-yl]-5-methyl-2H-indazol-3-one Openeye Name: 1-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)chroman-4-yl]-5-methyl-2H-indazol-3-one CAS Name: 1-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydro-2H-1-benzopyran-4-yl]-5-methyl-2H-indazol-3-one IUPAC Name: 1-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydrochromen-4-yl]-5-methyl-2H-indazol-3-one Traditional Name: 1-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)chroman-4-yl]-5-methyl-indazolin-3-one Formula: C20H19F3N2O4 MolecularWeight: 408.37107

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(NC2=O)C3C(C(OC4=C3C=C(C=C4)OC(F)(F)F)(C)C)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(NC2=O)C3C(C(OC4=C3C=C(C=C4)OC(F)(F)F)(C)C)O

InChI

InChI=1S/C20H19F3N2O4/c1-10-4-6-14-12(8-10)18(27)24-25(14)16-13-9-11(28-20(21,22)23)5-7-15(13)29-19(2,3)17(16)26/h4-9,16-17,26H,1-3H3,(H,24,27)