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

Systemtic Name: (4E)-4-[(3-butoxyphenyl)-oxidanyl-methylidene]-5-(4-iodophenyl)-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-iodophenyl)-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-iodophenyl)-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-butoxyphenyl)-hydroxymethylidene]-5-(4-iodophenyl)-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(4-iodophenyl)-1-phenethyl-pyrrolidine-2,3-quinone Formula: C29H28INO4 MolecularWeight: 581.44139

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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)I)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)I)/O

InChI

InChI=1S/C29H28INO4/c1-2-3-18-35-24-11-7-10-22(19-24)27(32)25-26(21-12-14-23(30)15-13-21)31(29(34)28(25)33)17-16-20-8-5-4-6-9-20/h4-15,19,26,32H,2-3,16-18H2,1H3/b27-25+