4-(4-bromanyl-2-ethoxy-phenoxy)butanoate

Systemtic Name: 4-(4-bromanyl-2-ethoxy-phenoxy)butanoate Openeye Name: 4-(4-bromo-2-ethoxy-phenoxy)butanoate CAS Name: 4-(4-bromo-2-ethoxyphenoxy)butanoate IUPAC Name: 4-(4-bromo-2-ethoxyphenoxy)butanoate Traditional Name: 4-(4-bromo-2-ethoxy-phenoxy)butyrate Formula: C12H14BrO4- MolecularWeight: 302.14116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)Br)OCCCC(=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)Br)OCCCC(=O)[O-]

InChI

InChI=1S/C12H15BrO4/c1-2-16-11-8-9(13)5-6-10(11)17-7-3-4-12(14)15/h5-6,8H,2-4,7H2,1H3,(H,14,15)/p-1