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

Systemtic Name: (4E)-4-[oxidanyl-(4-phenylmethoxyphenyl)methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(4-benzyloxyphenyl)-hydroxy-methylene]-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (4E)-4-[hydroxy-(4-phenylmethoxyphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-4-[hydroxy-(4-phenylmethoxyphenyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (4E)-4-[(4-benzoxyphenyl)-hydroxy-methylene]-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=C3C(NC(=O)C3=O)C4=CC=CS4)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)/C(=C\3/C(NC(=O)C3=O)C4=CC=CS4)/O

InChI

InChI=1S/C22H17NO4S/c24-20(18-19(17-7-4-12-28-17)23-22(26)21(18)25)15-8-10-16(11-9-15)27-13-14-5-2-1-3-6-14/h1-12,19,24H,13H2,(H,23,26)/b20-18+