[2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-6-(trifluoromethylsulfonyl)-3,4-dihydrochromen-3-yl] nitrate

Systemtic Name: [2,2-dimethyl-4-(3-oxidanylidene-1H-isoindol-2-yl)-6-(trifluoromethylsulfonyl)-3,4-dihydrochromen-3-yl] nitrate Openeye Name: [2,2-dimethyl-4-(1-oxoisoindolin-2-yl)-6-(trifluoromethylsulfonyl)chroman-3-yl] nitrate CAS Name: nitric acid [2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-6-(trifluoromethylsulfonyl)-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [2,2-dimethyl-4-(3-oxo-1H-isoindol-2-yl)-6-(trifluoromethylsulfonyl)-3,4-dihydrochromen-3-yl] nitrate Traditional Name: nitric acid [4-(1-ketoisoindolin-2-yl)-2,2-dimethyl-6-triflyl-chroman-3-yl] ester Formula: C20H17F3N2O7S MolecularWeight: 486.41839

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C(F)(F)F)N3CC4=CC=CC=C4C3=O)O[N+](=O)[O-])C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)S(=O)(=O)C(F)(F)F)N3CC4=CC=CC=C4C3=O)O[N+](=O)[O-])C

InChI

InChI=1S/C20H17F3N2O7S/c1-19(2)17(32-25(27)28)16(24-10-11-5-3-4-6-13(11)18(24)26)14-9-12(7-8-15(14)31-19)33(29,30)20(21,22)23/h3-9,16-17H,10H2,1-2H3