2-methyl-3-piperidin-4-yl-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]isoindol-1-one

Systemtic Name: 2-methyl-3-piperidin-4-yl-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]isoindol-1-one Openeye Name: 2-methyl-3-(4-piperidyl)-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]isoindolin-1-one CAS Name: 2-methyl-3-(4-piperidinyl)-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]-1-isoindolone IUPAC Name: 2-methyl-3-piperidin-4-yl-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]isoindol-1-one Traditional Name: 2-methyl-3-(4-piperidyl)-3-[2-[4-(trifluoromethyl)phenoxy]ethyl]isoindolin-1-one Formula: C23H25F3N2O2 MolecularWeight: 418.45201

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C1(CCOC3=CC=C(C=C3)C(F)(F)F)C4CCNCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C1(CCOC3=CC=C(C=C3)C(F)(F)F)C4CCNCC4

InChI

InChI=1S/C23H25F3N2O2/c1-28-21(29)19-4-2-3-5-20(19)22(28,16-10-13-27-14-11-16)12-15-30-18-8-6-17(7-9-18)23(24,25)26/h2-9,16,27H,10-15H2,1H3