2-(4-phenoxyphenyl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-(4-phenoxyphenyl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-(4-phenoxyphenyl)-7-(4-pyridylmethylamino)isoindolin-1-one CAS Name: 2-(4-phenoxyphenyl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-(4-phenoxyphenyl)-7-(pyridin-4-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-(4-phenoxyphenyl)-7-(4-pyridylmethylamino)isoindolin-1-one Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC=C2)NCC3=CC=NC=C3)C(=O)N1C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1C2=C(C(=CC=C2)NCC3=CC=NC=C3)C(=O)N1C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H21N3O2/c30-26-25-20(5-4-8-24(25)28-17-19-13-15-27-16-14-19)18-29(26)21-9-11-23(12-10-21)31-22-6-2-1-3-7-22/h1-16,28H,17-18H2