[2,4-bis(bromanyl)-6-methyl-phenyl] 4-phenethyloxybenzoate

Systemtic Name: [2,4-bis(bromanyl)-6-methyl-phenyl] 4-phenethyloxybenzoate Openeye Name: (2,4-dibromo-6-methyl-phenyl) 4-phenethyloxybenzoate CAS Name: 4-phenethyloxybenzoic acid (2,4-dibromo-6-methylphenyl) ester IUPAC Name: (2,4-dibromo-6-methylphenyl) 4-phenethyloxybenzoate Traditional Name: 4-phenethyloxybenzoic acid (2,4-dibromo-6-methyl-phenyl) ester Formula: C22H18Br2O3 MolecularWeight: 490.18452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=CC=C(C=C2)OCCC3=CC=CC=C3)Br)Br

InChI

InChI=1S/C22H18Br2O3/c1-15-13-18(23)14-20(24)21(15)27-22(25)17-7-9-19(10-8-17)26-12-11-16-5-3-2-4-6-16/h2-10,13-14H,11-12H2,1H3