3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]-4H-isochromen-1-one

Systemtic Name: 3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]-4H-isochromen-1-one Openeye Name: 3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]isochroman-1-one CAS Name: 3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]-4H-isochromen-1-one Traditional Name: 3-(2-dimethylaminoethyl)-3-[4-(trifluoromethyl)phenyl]isochroman-1-one Formula: C20H20F3NO2 MolecularWeight: 363.37351

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3NO2/c1-24(2)12-11-19(15-7-9-16(10-8-15)20(21,22)23)13-14-5-3-4-6-17(14)18(25)26-19/h3-10H,11-13H2,1-2H3