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

Systemtic Name: 5-[1-(4-bromophenyl)-4-methyl-pent-1-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[3-(4-bromophenyl)-1-isopropyl-prop-2-ynyl]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[1-(4-bromophenyl)-4-methylpent-1-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[1-(4-bromophenyl)-4-methylpent-1-yn-3-yl]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[3-(4-bromophenyl)-1-isopropyl-prop-2-ynyl]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H19BrO4 MolecularWeight: 379.24506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrO4/c1-11(2)14(10-7-12-5-8-13(19)9-6-12)15-16(20)22-18(3,4)23-17(15)21/h5-6,8-9,11,14-15H,1-4H3