2-[4-[(4-bromanyl-3-methyl-phenoxy)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(4-bromanyl-3-methyl-phenoxy)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(4-bromo-3-methyl-phenoxy)methyl]phenyl]acetate CAS Name: 2-[4-[(4-bromo-3-methylphenoxy)methyl]phenyl]acetate IUPAC Name: 2-[4-[(4-bromo-3-methylphenoxy)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-bromo-3-methyl-phenoxy)methyl]phenyl]acetate Formula: C16H14BrO3- MolecularWeight: 334.18456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CC=C(C=C2)CC(=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CC=C(C=C2)CC(=O)[O-])Br

InChI

InChI=1S/C16H15BrO3/c1-11-8-14(6-7-15(11)17)20-10-13-4-2-12(3-5-13)9-16(18)19/h2-8H,9-10H2,1H3,(H,18,19)/p-1