(2-bromanyl-4-butan-2-yl-phenyl) 3-bromanyl-4-(3-methylbutoxy)benzoate

Systemtic Name: (2-bromanyl-4-butan-2-yl-phenyl) 3-bromanyl-4-(3-methylbutoxy)benzoate Openeye Name: (2-bromo-4-sec-butyl-phenyl) 3-bromo-4-isopentyloxy-benzoate CAS Name: 3-bromo-4-(3-methylbutoxy)benzoic acid (2-bromo-4-butan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-butan-2-ylphenyl) 3-bromo-4-(3-methylbutoxy)benzoate Traditional Name: 3-bromo-4-isoamoxy-benzoic acid (2-bromo-4-sec-butyl-phenyl) ester Formula: C22H26Br2O3 MolecularWeight: 498.24804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br)Br

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OC(=O)C2=CC(=C(C=C2)OCCC(C)C)Br)Br

InChI

InChI=1S/C22H26Br2O3/c1-5-15(4)16-6-9-21(19(24)12-16)27-22(25)17-7-8-20(18(23)13-17)26-11-10-14(2)3/h6-9,12-15H,5,10-11H2,1-4H3