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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCC1=CC2=C(C=C1)OCC(O2)(CBr)O

Isomeric SMILES

CCC(C)CCC1=CC2=C(C=C1)OCC(O2)(CBr)O

InChI

InChI=1S/C15H21BrO3/c1-3-11(2)4-5-12-6-7-13-14(8-12)19-15(17,9-16)10-18-13/h6-8,11,17H,3-5,9-10H2,1-2H3