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

Systemtic Name: 2-[2,2-dimethyl-3-oxidanyl-6-(trifluoromethyloxy)-3,4-dihydrochromen-4-yl]-5,6-dimethoxy-1H-indazol-3-one Openeye Name: 2-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)chroman-4-yl]-5,6-dimethoxy-1H-indazol-3-one CAS Name: 2-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydro-2H-1-benzopyran-4-yl]-5,6-dimethoxy-1H-indazol-3-one IUPAC Name: 2-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)-3,4-dihydrochromen-4-yl]-5,6-dimethoxy-1H-indazol-3-one Traditional Name: 2-[3-hydroxy-2,2-dimethyl-6-(trifluoromethoxy)chroman-4-yl]-5,6-dimethoxy-indazolin-3-one Formula: C21H21F3N2O6 MolecularWeight: 454.39645

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)OC(F)(F)F)N3C(=O)C4=CC(=C(C=C4N3)OC)OC)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)OC(F)(F)F)N3C(=O)C4=CC(=C(C=C4N3)OC)OC)O)C

InChI

InChI=1S/C21H21F3N2O6/c1-20(2)18(27)17(12-7-10(31-21(22,23)24)5-6-14(12)32-20)26-19(28)11-8-15(29-3)16(30-4)9-13(11)25-26/h5-9,17-18,25,27H,1-4H3