5-[(E)-1,5-diphenylpent-1-en-4-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(E)-1,5-diphenylpent-1-en-4-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 2,2-dimethyl-5-[(E)-3-phenyl-1-(2-phenylethynyl)allyl]-1,3-dioxane-4,6-dione CAS Name: 5-[(E)-1,5-diphenylpent-1-en-4-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(E)-1,5-diphenylpent-1-en-4-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 2,2-dimethyl-5-[(E)-3-phenyl-1-(2-phenylethynyl)allyl]-1,3-dioxane-4,6-quinone Formula: C23H20O4 MolecularWeight: 360.4025

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)C(C=CC2=CC=CC=C2)C#CC3=CC=CC=C3)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)C(/C=C/C2=CC=CC=C2)C#CC3=CC=CC=C3)C

InChI

InChI=1S/C23H20O4/c1-23(2)26-21(24)20(22(25)27-23)19(15-13-17-9-5-3-6-10-17)16-14-18-11-7-4-8-12-18/h3-13,15,19-20H,1-2H3/b15-13+