(3E,6E)-3-[(5-phenylmethoxypyridin-2-yl)methylidene]-6-(pyridin-3-ylmethylidene)piperazine-2,5-dione

Systemtic Name: (3E,6E)-3-[(5-phenylmethoxypyridin-2-yl)methylidene]-6-(pyridin-3-ylmethylidene)piperazine-2,5-dione Openeye Name: (3E,6E)-3-[(5-benzyloxy-2-pyridyl)methylene]-6-(3-pyridylmethylene)piperazine-2,5-dione CAS Name: (3E,6E)-3-[(5-phenylmethoxy-2-pyridinyl)methylidene]-6-(3-pyridinylmethylidene)piperazine-2,5-dione IUPAC Name: (3E,6E)-3-[(5-phenylmethoxypyridin-2-yl)methylidene]-6-(pyridin-3-ylmethylidene)piperazine-2,5-dione Traditional Name: (3E,6E)-3-[(5-benzoxy-2-pyridyl)methylene]-6-(3-pyridylmethylene)piperazine-2,5-quinone Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CN=C(C=C2)C=C3C(=O)NC(=CC4=CN=CC=C4)C(=O)N3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CN=C(C=C2)/C=C/3\C(=O)N/C(=C/C4=CN=CC=C4)/C(=O)N3

InChI

InChI=1S/C23H18N4O3/c28-22-20(11-17-7-4-10-24-13-17)26-23(29)21(27-22)12-18-8-9-19(14-25-18)30-15-16-5-2-1-3-6-16/h1-14H,15H2,(H,26,29)(H,27,28)/b20-11+,21-12+