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

Systemtic Name: 3-bromanyl-4-[2-(4-chloranyl-3-methyl-phenoxy)ethoxy]benzoate Openeye Name: 3-bromo-4-[2-(4-chloro-3-methyl-phenoxy)ethoxy]benzoate CAS Name: 3-bromo-4-[2-(4-chloro-3-methylphenoxy)ethoxy]benzoate IUPAC Name: 3-bromo-4-[2-(4-chloro-3-methylphenoxy)ethoxy]benzoate Traditional Name: 3-bromo-4-[2-(4-chloro-3-methyl-phenoxy)ethoxy]benzoate Formula: C16H13BrClO4- MolecularWeight: 384.62902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrClO4/c1-10-8-12(3-4-14(10)18)21-6-7-22-15-5-2-11(16(19)20)9-13(15)17/h2-5,8-9H,6-7H2,1H3,(H,19,20)/p-1