ethyl 5-[3-(4-bromanylphenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylate

Systemtic Name: ethyl 5-[3-(4-bromanylphenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylate Openeye Name: ethyl 5-[3-(4-bromophenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylate CAS Name: 5-[3-(4-bromophenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-bromophenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylate Traditional Name: 5-[3-(4-bromophenoxy)propyl]-2-methyl-1,3-dioxane-2-carboxylic acid ethyl ester Formula: C17H23BrO5 MolecularWeight: 387.26552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(OCC(CO1)CCCOC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCOC(=O)C1(OCC(CO1)CCCOC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C17H23BrO5/c1-3-20-16(19)17(2)22-11-13(12-23-17)5-4-10-21-15-8-6-14(18)7-9-15/h6-9,13H,3-5,10-12H2,1-2H3