3-bromanyl-4-pentoxy-benzoate

Systemtic Name: 3-bromanyl-4-pentoxy-benzoate Openeye Name: 3-bromo-4-pentoxy-benzoate CAS Name: 3-bromo-4-pentoxybenzoate IUPAC Name: 3-bromo-4-pentoxybenzoate Traditional Name: 4-amoxy-3-bromo-benzoate Formula: C12H14BrO3- MolecularWeight: 286.14176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C(=O)[O-])Br

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C(=O)[O-])Br

InChI

InChI=1S/C12H15BrO3/c1-2-3-4-7-16-11-6-5-9(12(14)15)8-10(11)13/h5-6,8H,2-4,7H2,1H3,(H,14,15)/p-1