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

Systemtic Name: 3-bromanyl-5-chloranyl-2-pentoxy-benzoic acid Openeye Name: 3-bromo-5-chloro-2-pentoxy-benzoic acid CAS Name: 3-bromo-5-chloro-2-pentoxybenzoic acid IUPAC Name: 3-bromo-5-chloro-2-pentoxybenzoic acid Traditional Name: 2-amoxy-3-bromo-5-chloro-benzoic acid Formula: C12H14BrClO3 MolecularWeight: 321.59476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1C(=O)O)Cl)Br

InChI

InChI=1S/C12H14BrClO3/c1-2-3-4-5-17-11-9(12(15)16)6-8(14)7-10(11)13/h6-7H,2-5H2,1H3,(H,15,16)