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

Systemtic Name: (4E)-5-(4-butoxyphenyl)-4-[oxidanyl(phenyl)methylidene]-1-phenethyl-pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylene]-1-phenethyl-pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-phenethylpyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylidene]-1-phenethylpyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylene]-1-phenethyl-pyrrolidine-2,3-quinone Formula: C29H29NO4 MolecularWeight: 455.54486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C29H29NO4/c1-2-3-20-34-24-16-14-22(15-17-24)26-25(27(31)23-12-8-5-9-13-23)28(32)29(33)30(26)19-18-21-10-6-4-7-11-21/h4-17,26,31H,2-3,18-20H2,1H3/b27-25+