2,2-dimethyl-5-[(3R)-4-methyl-1-phenyl-pent-1-yn-3-yl]-1,3-dioxane-4,6-dione

Systemtic Name: 2,2-dimethyl-5-[(3R)-4-methyl-1-phenyl-pent-1-yn-3-yl]-1,3-dioxane-4,6-dione Openeye Name: 5-[(1R)-1-isopropyl-3-phenyl-prop-2-ynyl]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 2,2-dimethyl-5-[(3R)-4-methyl-1-phenylpent-1-yn-3-yl]-1,3-dioxane-4,6-dione IUPAC Name: 2,2-dimethyl-5-[(3R)-4-methyl-1-phenylpent-1-yn-3-yl]-1,3-dioxane-4,6-dione Traditional Name: 5-[(1R)-1-isopropyl-3-phenyl-prop-2-ynyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC1=CC=CC=C1)C2C(=O)OC(OC2=O)(C)C

Isomeric SMILES

CC(C)[C@@H](C#CC1=CC=CC=C1)C2C(=O)OC(OC2=O)(C)C

InChI

InChI=1S/C18H20O4/c1-12(2)14(11-10-13-8-6-5-7-9-13)15-16(19)21-18(3,4)22-17(15)20/h5-9,12,14-15H,1-4H3/t14-/m1/s1