1-[2,5-bis(bromanyl)-4-octanoyl-phenyl]octan-1-one

Systemtic Name: 1-[2,5-bis(bromanyl)-4-octanoyl-phenyl]octan-1-one Openeye Name: 1-(2,5-dibromo-4-octanoyl-phenyl)octan-1-one CAS Name: 1-[2,5-dibromo-4-(1-oxooctyl)phenyl]-1-octanone IUPAC Name: 1-(2,5-dibromo-4-octanoylphenyl)octan-1-one Traditional Name: 1-(2,5-dibromo-4-caprylyl-phenyl)octan-1-one Formula: C22H32Br2O2 MolecularWeight: 488.29628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC(=C(C=C1Br)C(=O)CCCCCCC)Br

Isomeric SMILES

CCCCCCCC(=O)C1=CC(=C(C=C1Br)C(=O)CCCCCCC)Br

InChI

InChI=1S/C22H32Br2O2/c1-3-5-7-9-11-13-21(25)17-15-20(24)18(16-19(17)23)22(26)14-12-10-8-6-4-2/h15-16H,3-14H2,1-2H3