(4E)-4-[[4-(2-methylpropoxy)phenyl]-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-4-[[4-(2-methylpropoxy)phenyl]-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[hydroxy-(4-isobutoxyphenyl)methylene]-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy-[4-(2-methylpropoxy)phenyl]methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy-(4-isobutoxyphenyl)methylene]-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C19H19NO4S MolecularWeight: 357.42346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=C2C(NC(=O)C2=O)C3=CC=CS3)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)/C(=C\2/C(NC(=O)C2=O)C3=CC=CS3)/O

InChI

InChI=1S/C19H19NO4S/c1-11(2)10-24-13-7-5-12(6-8-13)17(21)15-16(14-4-3-9-25-14)20-19(23)18(15)22/h3-9,11,16,21H,10H2,1-2H3,(H,20,23)/b17-15+