(4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(4-pyridyl)methylene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione CAS Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(pyridin-4-yl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(pyridin-4-yl)methylidene]-5-(4-nitrophenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(4-pyridyl)methylene]-5-(4-nitrophenyl)pyrrolidine-2,3-quinone Formula: C25H18N4O6S MolecularWeight: 502.49862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=NC=C4)O)C(=O)C3=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3C(/C(=C(/C4=CC=NC=C4)\O)/C(=O)C3=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H18N4O6S/c1-2-35-17-7-8-18-19(13-17)36-25(27-18)28-21(14-3-5-16(6-4-14)29(33)34)20(23(31)24(28)32)22(30)15-9-11-26-12-10-15/h3-13,21,30H,2H2,1H3/b22-20+