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

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(4-ethoxyphenyl)-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-ethoxyphenyl)-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-ethoxyphenyl)-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-ethoxyphenyl)-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-1-phenethyl-5-p-phenetyl-pyrrolidine-2,3-quinone Formula: C31H33NO5 MolecularWeight: 499.59742

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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)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)OCC)/O

InChI

InChI=1S/C31H33NO5/c1-3-5-20-37-26-13-9-12-24(21-26)29(33)27-28(23-14-16-25(17-15-23)36-4-2)32(31(35)30(27)34)19-18-22-10-7-6-8-11-22/h6-17,21,28,33H,3-5,18-20H2,1-2H3/b29-27+