4-[[2,6-bis(bromanyl)-4-methyl-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[2,6-bis(bromanyl)-4-methyl-phenoxy]methyl]benzoic acid Openeye Name: 4-[(2,6-dibromo-4-methyl-phenoxy)methyl]benzoic acid CAS Name: 4-[(2,6-dibromo-4-methylphenoxy)methyl]benzoic acid IUPAC Name: 4-[(2,6-dibromo-4-methylphenoxy)methyl]benzoic acid Traditional Name: 4-[(2,6-dibromo-4-methyl-phenoxy)methyl]benzoic acid Formula: C15H12Br2O3 MolecularWeight: 400.06198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)C(=O)O)Br

InChI

InChI=1S/C15H12Br2O3/c1-9-6-12(16)14(13(17)7-9)20-8-10-2-4-11(5-3-10)15(18)19/h2-7H,8H2,1H3,(H,18,19)