3-(2-bromanyl-6-propyl-phenoxy)propane-1,2-diol

Systemtic Name: 3-(2-bromanyl-6-propyl-phenoxy)propane-1,2-diol Openeye Name: 3-(2-bromo-6-propyl-phenoxy)propane-1,2-diol CAS Name: 3-(2-bromo-6-propylphenoxy)propane-1,2-diol IUPAC Name: 3-(2-bromo-6-propylphenoxy)propane-1,2-diol Traditional Name: 3-(2-bromo-6-propyl-phenoxy)propane-1,2-diol Formula: C12H17BrO3 MolecularWeight: 289.16558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC=C1)Br)OCC(CO)O

Isomeric SMILES

CCCC1=C(C(=CC=C1)Br)OCC(CO)O

InChI

InChI=1S/C12H17BrO3/c1-2-4-9-5-3-6-11(13)12(9)16-8-10(15)7-14/h3,5-6,10,14-15H,2,4,7-8H2,1H3