3-bromanyl-2-(4-oxidanylhexoxy)benzoic acid

Systemtic Name: 3-bromanyl-2-(4-oxidanylhexoxy)benzoic acid Openeye Name: 3-bromo-2-(4-hydroxyhexoxy)benzoic acid CAS Name: 3-bromo-2-(4-hydroxyhexoxy)benzoic acid IUPAC Name: 3-bromo-2-(4-hydroxyhexoxy)benzoic acid Traditional Name: 3-bromo-2-(4-hydroxyhexoxy)benzoic acid Formula: C13H17BrO4 MolecularWeight: 317.17568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCOC1=C(C=CC=C1Br)C(=O)O)O

Isomeric SMILES

CCC(CCCOC1=C(C=CC=C1Br)C(=O)O)O

InChI

InChI=1S/C13H17BrO4/c1-2-9(15)5-4-8-18-12-10(13(16)17)6-3-7-11(12)14/h3,6-7,9,15H,2,4-5,8H2,1H3,(H,16,17)