3-bromanyl-5-chloranyl-2-hexoxy-benzoic acid

Systemtic Name: 3-bromanyl-5-chloranyl-2-hexoxy-benzoic acid Openeye Name: 3-bromo-5-chloro-2-hexoxy-benzoic acid CAS Name: 3-bromo-5-chloro-2-hexoxybenzoic acid IUPAC Name: 3-bromo-5-chloro-2-hexoxybenzoic acid Traditional Name: 3-bromo-5-chloro-2-hexoxy-benzoic acid Formula: C13H16BrClO3 MolecularWeight: 335.62134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

InChI

InChI=1S/C13H16BrClO3/c1-2-3-4-5-6-18-12-10(13(16)17)7-9(15)8-11(12)14/h7-8H,2-6H2,1H3,(H,16,17)