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

Systemtic Name: (4E)-4-[(3-ethoxyphenyl)-oxidanyl-methylidene]-1-phenethyl-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(3-ethoxyphenyl)-hydroxy-methylene]-1-phenethyl-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-phenethyl-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[(3-ethoxyphenyl)-hydroxymethylidene]-1-phenethyl-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[hydroxy(m-phenetyl)methylene]-1-phenethyl-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C25H23NO4S MolecularWeight: 433.51942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC=CS4)O

Isomeric SMILES

CCOC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCC3=CC=CC=C3)C4=CC=CS4)/O

InChI

InChI=1S/C25H23NO4S/c1-2-30-19-11-6-10-18(16-19)23(27)21-22(20-12-7-15-31-20)26(25(29)24(21)28)14-13-17-8-4-3-5-9-17/h3-12,15-16,22,27H,2,13-14H2,1H3/b23-21+