[5-ethoxy-6-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone

Systemtic Name: [5-ethoxy-6-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone Openeye Name: [5-ethoxy-6-(trifluoromethyl)isoindolin-2-yl]-(2-isopropoxy-5-methylsulfonyl-phenyl)methanone CAS Name: [5-ethoxy-6-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone IUPAC Name: [5-ethoxy-6-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone Traditional Name: [5-ethoxy-6-(trifluoromethyl)isoindolin-2-yl]-(2-isopropoxy-5-mesyl-phenyl)methanone Formula: C22H24F3NO5S MolecularWeight: 471.48987

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC(C)C)C(F)(F)F

Isomeric SMILES

CCOC1=C(C=C2CN(CC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC(C)C)C(F)(F)F

InChI

InChI=1S/C22H24F3NO5S/c1-5-30-20-9-15-12-26(11-14(15)8-18(20)22(23,24)25)21(27)17-10-16(32(4,28)29)6-7-19(17)31-13(2)3/h6-10,13H,5,11-12H2,1-4H3