3-bromanyl-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate

Systemtic Name: 3-bromanyl-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate Openeye Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate CAS Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate IUPAC Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate Traditional Name: 3-bromo-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzoate Formula: C18H18BrO4- MolecularWeight: 378.23712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCOC2=C(C=C(C=C2)C(=O)[O-])Br)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCOC2=C(C=C(C=C2)C(=O)[O-])Br)C

InChI

InChI=1S/C18H19BrO4/c1-11-4-5-12(2)17(13(11)3)23-9-8-22-16-7-6-14(18(20)21)10-15(16)19/h4-7,10H,8-9H2,1-3H3,(H,20,21)/p-1