2-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(trifluoromethyl)phenyl]amino]-3H-isoindol-1-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(trifluoromethyl)phenyl]amino]-3H-isoindol-1-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]isoindolin-1-one CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]-3H-isoindol-1-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(trifluoromethyl)anilino]-3H-isoindol-1-one Traditional Name: 2-piperonyl-3-[2-(trifluoromethyl)anilino]isoindolin-1-one Formula: C23H17F3N2O3 MolecularWeight: 426.38789

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C23H17F3N2O3/c24-23(25,26)17-7-3-4-8-18(17)27-21-15-5-1-2-6-16(15)22(29)28(21)12-14-9-10-19-20(11-14)31-13-30-19/h1-11,21,27H,12-13H2