2-[4-[(4-bromanyl-2,3-dimethyl-phenoxy)methyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-bromanyl-2,3-dimethyl-phenoxy)methyl]phenyl]ethanoic acid Openeye Name: 2-[4-[(4-bromo-2,3-dimethyl-phenoxy)methyl]phenyl]acetic acid CAS Name: 2-[4-[(4-bromo-2,3-dimethylphenoxy)methyl]phenyl]acetic acid IUPAC Name: 2-[4-[(4-bromo-2,3-dimethylphenoxy)methyl]phenyl]acetic acid Traditional Name: 2-[4-[(4-bromo-2,3-dimethyl-phenoxy)methyl]phenyl]acetic acid Formula: C17H17BrO3 MolecularWeight: 349.21908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)Br)OCC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1C)Br)OCC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C17H17BrO3/c1-11-12(2)16(8-7-15(11)18)21-10-14-5-3-13(4-6-14)9-17(19)20/h3-8H,9-10H2,1-2H3,(H,19,20)