5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane

Systemtic Name: 5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane Openeye Name: 5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane CAS Name: 5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane IUPAC Name: 5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane Traditional Name: 5-(3-bromophenyl)-2,2-dimethyl-1,3-dioxane Formula: C12H15BrO2 MolecularWeight: 271.1503

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1(OCC(CO1)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C12H15BrO2/c1-12(2)14-7-10(8-15-12)9-4-3-5-11(13)6-9/h3-6,10H,7-8H2,1-2H3