5-bromanyl-2-butoxy-3-methoxy-benzoate

Systemtic Name: 5-bromanyl-2-butoxy-3-methoxy-benzoate Openeye Name: 5-bromo-2-butoxy-3-methoxy-benzoate CAS Name: 5-bromo-2-butoxy-3-methoxybenzoate IUPAC Name: 5-bromo-2-butoxy-3-methoxybenzoate Traditional Name: 5-bromo-2-butoxy-3-methoxy-benzoate Formula: C12H14BrO4- MolecularWeight: 302.14116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1C(=O)[O-])Br)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1C(=O)[O-])Br)OC

InChI

InChI=1S/C12H15BrO4/c1-3-4-5-17-11-9(12(14)15)6-8(13)7-10(11)16-2/h6-7H,3-5H2,1-2H3,(H,14,15)/p-1