3-(4-bromanyl-2-propyl-phenoxy)propane-1,2-diol

Systemtic Name: 3-(4-bromanyl-2-propyl-phenoxy)propane-1,2-diol Openeye Name: 3-(4-bromo-2-propyl-phenoxy)propane-1,2-diol CAS Name: 3-(4-bromo-2-propylphenoxy)propane-1,2-diol IUPAC Name: 3-(4-bromo-2-propylphenoxy)propane-1,2-diol Traditional Name: 3-(4-bromo-2-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/c1-2-3-9-6-10(13)4-5-12(9)16-8-11(15)7-14/h4-6,11,14-15H,2-3,7-8H2,1H3