(4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(3-ethoxy-4-oxidanyl-phenyl)-1-phenethyl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(3-ethoxy-4-oxidanyl-phenyl)-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3-ethoxy-4-hydroxy-phenyl)-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(3-ethoxy-4-hydroxyphenyl)-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(3-ethoxy-4-hydroxyphenyl)-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3-ethoxy-4-hydroxy-phenyl)-1-phenethyl-pyrrolidine-2,3-quinone Formula: C31H33NO6 MolecularWeight: 515.59682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC(=C(C=C4)O)OCC)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC(=C(C=C4)O)OCC)/O

InChI

InChI=1S/C31H33NO6/c1-3-5-18-38-24-13-9-12-23(19-24)29(34)27-28(22-14-15-25(33)26(20-22)37-4-2)32(31(36)30(27)35)17-16-21-10-7-6-8-11-21/h6-15,19-20,28,33-34H,3-5,16-18H2,1-2H3/b29-27+