3-[2-(4-bromanyl-2-methyl-phenoxy)ethoxy]benzoate

Systemtic Name: 3-[2-(4-bromanyl-2-methyl-phenoxy)ethoxy]benzoate Openeye Name: 3-[2-(4-bromo-2-methyl-phenoxy)ethoxy]benzoate CAS Name: 3-[2-(4-bromo-2-methylphenoxy)ethoxy]benzoate IUPAC Name: 3-[2-(4-bromo-2-methylphenoxy)ethoxy]benzoate Traditional Name: 3-[2-(4-bromo-2-methyl-phenoxy)ethoxy]benzoate Formula: C16H14BrO4- MolecularWeight: 350.18396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrO4/c1-11-9-13(17)5-6-15(11)21-8-7-20-14-4-2-3-12(10-14)16(18)19/h2-6,9-10H,7-8H2,1H3,(H,18,19)/p-1