2-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethoxy]benzoate

Systemtic Name: 2-[2-(2-bromanyl-4,6-dimethyl-phenoxy)ethoxy]benzoate Openeye Name: 2-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]benzoate CAS Name: 2-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]benzoate IUPAC Name: 2-[2-(2-bromo-4,6-dimethylphenoxy)ethoxy]benzoate Traditional Name: 2-[2-(2-bromo-4,6-dimethyl-phenoxy)ethoxy]benzoate Formula: C17H16BrO4- MolecularWeight: 364.21054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCCOC2=CC=CC=C2C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCCOC2=CC=CC=C2C(=O)[O-])C

InChI

InChI=1S/C17H17BrO4/c1-11-9-12(2)16(14(18)10-11)22-8-7-21-15-6-4-3-5-13(15)17(19)20/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)/p-1