4-(1,3-benzodioxol-5-ylcarbonyl)-5-pyridin-2-yl-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonyl)-5-pyridin-2-yl-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione Openeye Name: 4-(1,3-benzodioxole-5-carbonyl)-5-(2-pyridyl)-1-(3-pyridylmethyl)pyrrolidine-2,3-dione CAS Name: 4-[1,3-benzodioxol-5-yl(oxo)methyl]-5-(2-pyridinyl)-1-(3-pyridinylmethyl)pyrrolidine-2,3-dione IUPAC Name: 4-(1,3-benzodioxole-5-carbonyl)-5-pyridin-2-yl-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione Traditional Name: 4-piperonyloyl-5-(2-pyridyl)-1-(3-pyridylmethyl)pyrrolidine-2,3-quinone Formula: C23H17N3O5 MolecularWeight: 415.39818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C3C(N(C(=O)C3=O)CC4=CN=CC=C4)C5=CC=CC=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)C3C(N(C(=O)C3=O)CC4=CN=CC=C4)C5=CC=CC=N5

InChI

InChI=1S/C23H17N3O5/c27-21(15-6-7-17-18(10-15)31-13-30-17)19-20(16-5-1-2-9-25-16)26(23(29)22(19)28)12-14-4-3-8-24-11-14/h1-11,19-20H,12-13H2