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

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-[(2-fluorophenyl)amino]-3H-isoindol-1-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluoroanilino)isoindolin-1-one CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluoroanilino)-3H-isoindol-1-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-3-(2-fluoroanilino)-3H-isoindol-1-one Traditional Name: 3-(2-fluoroanilino)-2-piperonyl-isoindolin-1-one Formula: C22H17FN2O3 MolecularWeight: 376.380383

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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=C5F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(C4=CC=CC=C4C3=O)NC5=CC=CC=C5F

InChI

InChI=1S/C22H17FN2O3/c23-17-7-3-4-8-18(17)24-21-15-5-1-2-6-16(15)22(26)25(21)12-14-9-10-19-20(11-14)28-13-27-19/h1-11,21,24H,12-13H2