3-[2,2-dimethyl-6-(trifluoromethylsulfonyl)chromen-4-yl]quinoline

Systemtic Name: 3-[2,2-dimethyl-6-(trifluoromethylsulfonyl)chromen-4-yl]quinoline Openeye Name: 3-[2,2-dimethyl-6-(trifluoromethylsulfonyl)chromen-4-yl]quinoline CAS Name: 3-[2,2-dimethyl-6-(trifluoromethylsulfonyl)-1-benzopyran-4-yl]quinoline IUPAC Name: 3-[2,2-dimethyl-6-(trifluoromethylsulfonyl)chromen-4-yl]quinoline Traditional Name: 3-(2,2-dimethyl-6-triflyl-chromen-4-yl)quinoline Formula: C21H16F3NO3S MolecularWeight: 419.41685

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)S(=O)(=O)C(F)(F)F)C3=CC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)S(=O)(=O)C(F)(F)F)C3=CC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C21H16F3NO3S/c1-20(2)11-17(14-9-13-5-3-4-6-18(13)25-12-14)16-10-15(7-8-19(16)28-20)29(26,27)21(22,23)24/h3-12H,1-2H3