2-[(4-bromanyl-2-methyl-phenoxy)methyl]benzoic acid

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenoxy)methyl]benzoic acid Openeye Name: 2-[(4-bromo-2-methyl-phenoxy)methyl]benzoic acid CAS Name: 2-[(4-bromo-2-methylphenoxy)methyl]benzoic acid IUPAC Name: 2-[(4-bromo-2-methylphenoxy)methyl]benzoic acid Traditional Name: 2-[(4-bromo-2-methyl-phenoxy)methyl]benzoic acid Formula: C15H13BrO3 MolecularWeight: 321.16592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H13BrO3/c1-10-8-12(16)6-7-14(10)19-9-11-4-2-3-5-13(11)15(17)18/h2-8H,9H2,1H3,(H,17,18)