3-(4-bromanyl-2,3,5-trimethyl-phenoxy)propanoate

Systemtic Name: 3-(4-bromanyl-2,3,5-trimethyl-phenoxy)propanoate Openeye Name: 3-(4-bromo-2,3,5-trimethyl-phenoxy)propanoate CAS Name: 3-(4-bromo-2,3,5-trimethylphenoxy)propanoate IUPAC Name: 3-(4-bromo-2,3,5-trimethylphenoxy)propanoate Traditional Name: 3-(4-bromo-2,3,5-trimethyl-phenoxy)propionate Formula: C12H14BrO3- MolecularWeight: 286.14176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Br)C)C)OCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1Br)C)C)OCCC(=O)[O-]

InChI

InChI=1S/C12H15BrO3/c1-7-6-10(16-5-4-11(14)15)8(2)9(3)12(7)13/h6H,4-5H2,1-3H3,(H,14,15)/p-1