5-(6-chloranyl-2-phenyl-hexan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-(6-chloranyl-2-phenyl-hexan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-(5-chloro-1-methyl-1-phenyl-pentyl)-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-(6-chloro-2-phenylhexan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-(6-chloro-2-phenylhexan-2-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-(5-chloro-1-methyl-1-phenyl-pentyl)-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C18H23ClO4 MolecularWeight: 338.82582

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(C(=O)O1)C(C)(CCCCCl)C2=CC=CC=C2)C

Isomeric SMILES

CC1(OC(=O)C(C(=O)O1)C(C)(CCCCCl)C2=CC=CC=C2)C

InChI

InChI=1S/C18H23ClO4/c1-17(2)22-15(20)14(16(21)23-17)18(3,11-7-8-12-19)13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3