2-[4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl]benzoate

Systemtic Name: 2-[4-[3-bromanyl-4-(2-methylbutoxy)phenyl]phenyl]benzoate Openeye Name: 2-[4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl]benzoate CAS Name: 2-[4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl]benzoate IUPAC Name: 2-[4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl]benzoate Traditional Name: 2-[4-[3-bromo-4-(2-methylbutoxy)phenyl]phenyl]benzoate Formula: C24H22BrO3- MolecularWeight: 438.33368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)[O-])Br

Isomeric SMILES

CCC(C)COC1=C(C=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)[O-])Br

InChI

InChI=1S/C24H23BrO3/c1-3-16(2)15-28-23-13-12-19(14-22(23)25)17-8-10-18(11-9-17)20-6-4-5-7-21(20)24(26)27/h4-14,16H,3,15H2,1-2H3,(H,26,27)/p-1