(3E,6E)-3-[(5-oxidanylpyridin-2-yl)methylidene]-6-phenethylidene-piperazine-2,5-dione

Systemtic Name: (3E,6E)-3-[(5-oxidanylpyridin-2-yl)methylidene]-6-phenethylidene-piperazine-2,5-dione Openeye Name: (3E,6E)-3-[(5-hydroxy-2-pyridyl)methylene]-6-phenethylidene-piperazine-2,5-dione CAS Name: (3E,6E)-3-[(5-hydroxy-2-pyridinyl)methylidene]-6-phenethylidenepiperazine-2,5-dione IUPAC Name: (3E,6E)-3-[(5-hydroxypyridin-2-yl)methylidene]-6-phenethylidenepiperazine-2,5-dione Traditional Name: (3E,6E)-3-[(5-hydroxy-2-pyridyl)methylene]-6-phenethylidene-piperazine-2,5-quinone Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=C2C(=O)NC(=CC3=NC=C(C=C3)O)C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)C/C=C/2\C(=O)N/C(=C/C3=NC=C(C=C3)O)/C(=O)N2

InChI

InChI=1S/C18H15N3O3/c22-14-8-7-13(19-11-14)10-16-18(24)20-15(17(23)21-16)9-6-12-4-2-1-3-5-12/h1-5,7-11,22H,6H2,(H,20,24)(H,21,23)/b15-9+,16-10+