(4E)-4-[(5-methyl-1-phenyl-pyrazol-4-yl)-oxidanyl-methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(5-methyl-1-phenyl-pyrazol-4-yl)-oxidanyl-methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione Openeye Name: (4E)-4-[hydroxy-(5-methyl-1-phenyl-pyrazol-4-yl)methylene]-1-(2-morpholinoethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy-(5-methyl-1-phenyl-4-pyrazolyl)methylidene]-1-[2-(4-morpholinyl)ethyl]-5-(4-nitrophenyl)pyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]-1-(2-morpholin-4-ylethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy-(5-methyl-1-phenyl-pyrazol-4-yl)methylene]-1-(2-morpholinoethyl)-5-(4-nitrophenyl)pyrrolidine-2,3-quinone Formula: C27H27N5O6 MolecularWeight: 517.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC=C(C=C5)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)/C(=C\3/C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC=C(C=C5)[N+](=O)[O-])/O

InChI

InChI=1S/C27H27N5O6/c1-18-22(17-28-31(18)20-5-3-2-4-6-20)25(33)23-24(19-7-9-21(10-8-19)32(36)37)30(27(35)26(23)34)12-11-29-13-15-38-16-14-29/h2-10,17,24,33H,11-16H2,1H3/b25-23+