2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol

Systemtic Name: 2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol Openeye Name: 2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol CAS Name: 2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol IUPAC Name: 2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol Traditional Name: 2-(bromomethyl)-6-(2-methylpentyl)-3H-1,4-benzodioxin-2-ol Formula: C15H21BrO3 MolecularWeight: 329.22944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC1=CC2=C(C=C1)OC(CO2)(CBr)O

Isomeric SMILES

CCCC(C)CC1=CC2=C(C=C1)OC(CO2)(CBr)O

InChI

InChI=1S/C15H21BrO3/c1-3-4-11(2)7-12-5-6-13-14(8-12)18-10-15(17,9-16)19-13/h5-6,8,11,17H,3-4,7,9-10H2,1-2H3