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

Systemtic Name: (4E)-5-(4-butoxyphenyl)-4-[oxidanyl(phenyl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-butoxyphenyl)-4-[hydroxy(phenyl)methylene]pyrrolidine-2,3-quinone Formula: C21H21NO4 MolecularWeight: 351.39574

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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)N2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2

InChI

InChI=1S/C21H21NO4/c1-2-3-13-26-16-11-9-14(10-12-16)18-17(20(24)21(25)22-18)19(23)15-7-5-4-6-8-15/h4-12,18,23H,2-3,13H2,1H3,(H,22,25)/b19-17+